Sunday, January 22, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 6a,9a-dichloro-2-(3-chloro-4-methyl-phenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a,9a-dichloro-2-(3-chloro-4-methylphenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6a,9a-dichloro-2-(3-chloro-4-methylphenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a,9a-bis(chloranyl)-2-(3-chloranyl-4-methyl-phenyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C37H30Cl3FN2O7
MOLECULAR WEIGHT: 740.000703
SMILES: CC1=C(C=C(C=C1)N2C(=O)C3CC=C4C(C3C2=O)CC5(C(=O)N(C(=O)C5(C4C=CC6=CC(=C(C(=C6)OC)O)OC)Cl)C7=CC=C(C=C7)F)Cl)Cl
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Product OPENEYE NAME: 6a,9a-dichloro-2-(4-chlorophenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a,9a-dichloro-2-(4-chlorophenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6a,9a-dichloro-2-(4-chlorophenyl)-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a,9a-bis(chloranyl)-2-(4-chlorophenyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C36H28Cl3FN2O7
MOLECULAR WEIGHT: 725.974123
SMILES: COC1=CC(=CC(=C1O)OC)C=CC2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=CC=C(C=C6)F)Cl)Cl)C(=O)N(C4=O)C7=CC=C(C=C7)Cl
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Product OPENEYE NAME: 2-(4-bromophenyl)-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 2-(4-bromophenyl)-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 2-(4-bromophenyl)-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 2-(4-bromophenyl)-6a,9a-bis(chloranyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C36H28BrCl2FN2O7
MOLECULAR WEIGHT: 770.425123
SMILES: COC1=CC(=CC(=C1O)OC)C=CC2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=CC=C(C=C6)F)Cl)Cl)C(=O)N(C4=O)C7=CC=C(C=C7)Br
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Product OPENEYE NAME: 6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-2-(4-iodophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2-(4-iodophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2-(4-iodophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a,9a-bis(chloranyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-2-(4-iodophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C36H28Cl2FIN2O7
MOLECULAR WEIGHT: 817.425593
SMILES: COC1=CC(=CC(=C1O)OC)C=CC2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=CC=C(C=C6)F)Cl)Cl)C(=O)N(C4=O)C7=CC=C(C=C7)I
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Product OPENEYE NAME: 6a,9a-dichloro-8-(4-fluorophenyl)-2-hydroxy-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a,9a-dichloro-8-(4-fluorophenyl)-2-hydroxy-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6a,9a-dichloro-8-(4-fluorophenyl)-2-hydroxy-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a,9a-bis(chloranyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-2-oxidanyl-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C30H25Cl2FN2O8
MOLECULAR WEIGHT: 631.432503
SMILES: COC1=CC(=CC(=C1O)OC)C=CC2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=CC=C(C=C6)F)Cl)Cl)C(=O)N(C4=O)O
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Product OPENEYE NAME: 2-tert-butyl-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxy-phenyl)vinyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 2-tert-butyl-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 2-tert-butyl-6a,9a-dichloro-8-(4-fluorophenyl)-6-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 2-tert-butyl-6a,9a-bis(chloranyl)-6-[2-(3,5-dimethoxy-4-oxidanyl-phenyl)ethenyl]-8-(4-fluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C34H33Cl2FN2O7
MOLECULAR WEIGHT: 671.539423
SMILES: CC(C)(C)N1C(=O)C2CC=C3C(C2C1=O)CC4(C(=O)N(C(=O)C4(C3C=CC5=CC(=C(C(=C5)OC)O)OC)Cl)C6=CC=C(C=C6)F)Cl
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Product OPENEYE NAME: 2-(2-nitro-2-phenyl-vinyl)sulfanylpyridin-1-ium
CAS Name: 2-[(2-nitro-2-phenylethenyl)thio]pyridin-1-ium
IUPAC NAME: 2-(2-nitro-2-phenylethenyl)sulfanylpyridin-1-ium
SYSTEMATIC NAME: 2-(2-nitro-2-phenyl-ethenyl)sulfanylpyridin-1-ium
MOLECULAR FORMULA: C13H11N2O2S+
MOLECULAR WEIGHT: 259.30364
SMILES: C1=CC=C(C=C1)C(=CSC2=CC=CC=[NH+]2)[N+](=O)[O-]
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Product OPENEYE NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonate
CAS Name: 3-[2-[3-ethyl-5-[5-methoxy-6-(methylthio)-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-(methylthio)-1,3-benzothiazol-3-yl]-1-propanesulfonate
IUPAC NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonate
SYSTEMATIC NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonate
MOLECULAR FORMULA: C31H37N2O8S6-
MOLECULAR WEIGHT: 758.02408
SMILES: CCC(=CC=C1N(C2=CC(=C(C=C2S1)SC)OC)CCCS(=O)(=O)[O-])C=CC3=[N+](C4=CC(=C(C=C4S3)SC)OC)CCCS(=O)(=O)[O-]
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Product OPENEYE NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonic acid
CAS Name: 3-[2-[3-ethyl-5-[5-methoxy-6-(methylthio)-3-(3-sulfopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-(methylthio)-1,3-benzothiazol-3-yl]-1-propanesulfonic acid
IUPAC NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonic acid
SYSTEMATIC NAME: 3-[2-[3-ethyl-5-[5-methoxy-6-methylsulfanyl-3-(3-sulfopropyl)-1,3-benzothiazol-3-ium-2-yl]penta-2,4-dienylidene]-5-methoxy-6-methylsulfanyl-1,3-benzothiazol-3-yl]propane-1-sulfonic acid
MOLECULAR FORMULA: C31H39N2O8S6+
MOLECULAR WEIGHT: 760.03996
SMILES: CCC(=CC=C1N(C2=CC(=C(C=C2S1)SC)OC)CCCS(=O)(=O)O)C=CC3=[N+](C4=CC(=C(C=C4S3)SC)OC)CCCS(=O)(=O)O
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Product OPENEYE NAME: 2-[(4-methylphenoxy)methyl]-5-(4-methyl-1-piperidyl)oxazole-4-carbonitrile
CAS Name: 2-[(4-methylphenoxy)methyl]-5-(4-methyl-1-piperidinyl)-4-oxazolecarbonitrile
IUPAC NAME: 2-[(4-methylphenoxy)methyl]-5-(4-methylpiperidin-1-yl)-1,3-oxazole-4-carbonitrile
SYSTEMATIC NAME: 2-[(4-methylphenoxy)methyl]-5-(4-methylpiperidin-1-yl)-1,3-oxazole-4-carbonitrile
MOLECULAR FORMULA: C18H21N3O2
MOLECULAR WEIGHT: 311.37824
SMILES: CC1CCN(CC1)C2=C(N=C(O2)COC3=CC=C(C=C3)C)C#N
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Product OPENEYE NAME: 2-bromo-3-phenyl-N-thiazol-2-yl-prop-2-enamide
CAS Name: 2-bromo-3-phenyl-N-(2-thiazolyl)-2-propenamide
IUPAC NAME: 2-bromo-3-phenyl-N-(1,3-thiazol-2-yl)prop-2-enamide
SYSTEMATIC NAME: 2-bromanyl-3-phenyl-N-(1,3-thiazol-2-yl)prop-2-enamide
MOLECULAR FORMULA: C12H9BrN2OS
MOLECULAR WEIGHT: 309.18166
SMILES: C1=CC=C(C=C1)C=C(C(=O)NC2=NC=CS2)Br
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Product OPENEYE NAME: 2-(2-hydroxyanilino)-5-[(4-hydroxyphenyl)methylene]thiazol-4-one
CAS Name: 2-(2-hydroxyanilino)-5-[(4-hydroxyphenyl)methylidene]-4-thiazolone
IUPAC NAME: 2-(2-hydroxyanilino)-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
SYSTEMATIC NAME: 2-[(2-hydroxyphenyl)amino]-5-[(4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
MOLECULAR FORMULA: C16H12N2O3S
MOLECULAR WEIGHT: 312.34308
SMILES: C1=CC=C(C(=C1)NC2=NC(=O)C(=CC3=CC=C(C=C3)O)S2)O
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Product OPENEYE NAME: [2-(2-isopropylanilino)-2-oxo-ethyl] 3-[4-[(4-chlorophenyl)methoxy]phenyl]prop-2-enoate
CAS Name: 3-[4-[(4-chlorophenyl)methoxy]phenyl]-2-propenoic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 3-[4-[(4-chlorophenyl)methoxy]phenyl]prop-2-enoate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 3-[4-[(4-chlorophenyl)methoxy]phenyl]prop-2-enoate
MOLECULAR FORMULA: C27H26ClNO4
MOLECULAR WEIGHT: 463.95264
SMILES: CC(C)C1=CC=CC=C1NC(=O)COC(=O)C=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 4-(4-anilino-6-methyl-pyrimidin-2-yl)sulfanyl-1-phenyl-butan-1-one
CAS Name: 4-[(4-anilino-6-methyl-2-pyrimidinyl)thio]-1-phenyl-1-butanone
IUPAC NAME: 4-(4-anilino-6-methylpyrimidin-2-yl)sulfanyl-1-phenylbutan-1-one
SYSTEMATIC NAME: 4-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)sulfanyl-1-phenyl-butan-1-one
MOLECULAR FORMULA: C21H21N3OS
MOLECULAR WEIGHT: 363.47594
SMILES: CC1=CC(=NC(=N1)SCCCC(=O)C2=CC=CC=C2)NC3=CC=CC=C3
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Product OPENEYE NAME: 4-methyl-N-tetralin-1-yl-benzamide
CAS Name: 4-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
IUPAC NAME: 4-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
SYSTEMATIC NAME: 4-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
MOLECULAR FORMULA: C18H19NO
MOLECULAR WEIGHT: 265.34956
SMILES: CC1=CC=C(C=C1)C(=O)NC2CCCC3=CC=CC=C23
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Product OPENEYE NAME: 1-(2,5-dichlorophenyl)-3-[(3-methylisoxazol-5-yl)amino]prop-2-en-1-one
CAS Name: 1-(2,5-dichlorophenyl)-3-[(3-methyl-5-isoxazolyl)amino]-2-propen-1-one
IUPAC NAME: 1-(2,5-dichlorophenyl)-3-[(3-methyl-1,2-oxazol-5-yl)amino]prop-2-en-1-one
SYSTEMATIC NAME: 1-[2,5-bis(chloranyl)phenyl]-3-[(3-methyl-1,2-oxazol-5-yl)amino]prop-2-en-1-one
MOLECULAR FORMULA: C13H10Cl2N2O2
MOLECULAR WEIGHT: 297.1367
SMILES: CC1=NOC(=C1)NC=CC(=O)C2=C(C=CC(=C2)Cl)Cl
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Product OPENEYE NAME: 2-(4-methylpiperazin-1-yl)cyclopentanone oxime
CAS Name: 2-(4-methyl-1-piperazinyl)-1-cyclopentanone oxime
IUPAC NAME: N-[2-(4-methylpiperazin-1-yl)cyclopentylidene]hydroxylamine
SYSTEMATIC NAME: N-[2-(4-methylpiperazin-1-yl)cyclopentylidene]hydroxylamine
MOLECULAR FORMULA: C10H19N3O
MOLECULAR WEIGHT: 197.27736
SMILES: CN1CCN(CC1)C2CCCC2=NO
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Product OPENEYE NAME: 1-(5-chloro-2-methyl-4-nitro-phenyl)-3-(4-fluorophenyl)urea
CAS Name: 1-(5-chloro-2-methyl-4-nitrophenyl)-3-(4-fluorophenyl)urea
IUPAC NAME: 1-(5-chloro-2-methyl-4-nitrophenyl)-3-(4-fluorophenyl)urea
SYSTEMATIC NAME: 1-(5-chloranyl-2-methyl-4-nitro-phenyl)-3-(4-fluorophenyl)urea
MOLECULAR FORMULA: C14H11ClFN3O3
MOLECULAR WEIGHT: 323.706843
SMILES: CC1=CC(=C(C=C1NC(=O)NC2=CC=C(C=C2)F)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: 1-(4-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]urea
CAS Name: 1-(4-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]urea
IUPAC NAME: 1-(4-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]urea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-[2-(4-fluorophenyl)ethyl]urea
MOLECULAR FORMULA: C15H14ClFN2O
MOLECULAR WEIGHT: 292.735863
SMILES: C1=CC(=CC=C1CCNC(=O)NC2=CC=C(C=C2)Cl)F
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Product OPENEYE NAME: 1-(3-chlorophenyl)-3-(3-methoxypropyl)urea
CAS Name: 1-(3-chlorophenyl)-3-(3-methoxypropyl)urea
IUPAC NAME: 1-(3-chlorophenyl)-3-(3-methoxypropyl)urea
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-(3-methoxypropyl)urea
MOLECULAR FORMULA: C11H15ClN2O2
MOLECULAR WEIGHT: 242.702
SMILES: COCCCNC(=O)NC1=CC(=CC=C1)Cl
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Product OPENEYE NAME: 2-cyclohexyl-1-hydroxy-3-oxido-phenanthro[9,10-d]imidazol-3-ium
CAS Name: 2-cyclohexyl-1-hydroxy-3-oxidophenanthro[9,10-d]imidazol-3-ium
IUPAC NAME: 2-cyclohexyl-1-hydroxy-3-oxidophenanthro[9,10-d]imidazol-3-ium
SYSTEMATIC NAME: 2-cyclohexyl-3-oxidanidyl-1-oxidanyl-phenanthro[9,10-d]imidazol-3-ium
MOLECULAR FORMULA: C21H20N2O2
MOLECULAR WEIGHT: 332.3957
SMILES: C1CCC(CC1)C2=[N+](C3=C(N2O)C4=CC=CC=C4C5=CC=CC=C53)[O-]
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Product OPENEYE NAME: 4-heptyl-N-(p-tolylmethyl)benzamide
CAS Name: 4-heptyl-N-[(4-methylphenyl)methyl]benzamide
IUPAC NAME: 4-heptyl-N-[(4-methylphenyl)methyl]benzamide
SYSTEMATIC NAME: 4-heptyl-N-[(4-methylphenyl)methyl]benzamide
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)C
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Product OPENEYE NAME: 2,3,4,5,6-pentafluoro-N-[[3-[4-[4-[[[2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methyl-amino]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
CAS Name: 2,3,4,5,6-pentafluoro-N-[[3-[4-[4-[[[2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
IUPAC NAME: 2,3,4,5,6-pentafluoro-N-[[3-[4-[4-[[[2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
SYSTEMATIC NAME: 2,3,4,5,6-pentakis(fluoranyl)-N-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[[[2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-amino]methyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
MOLECULAR FORMULA: C41H37F5N2O6
MOLECULAR WEIGHT: 748.734296
SMILES: CN(CC1CC(OC(O1)C2=CC=C(C=C2)C3=CC(=CC=C3)CNC(=O)C4=C(C(=C(C(=C4F)F)F)F)F)C5=CC=C(C=C5)CO)CC(C6=CC(=CC=C6)O)O
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Product OPENEYE NAME: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]-1,3-dioxan-2-yl]phenyl]-3-(4-phenoxyphenyl)urea
CAS Name: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]-1,3-dioxan-2-yl]phenyl]-3-(4-phenoxyphenyl)urea
IUPAC NAME: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]-1,3-dioxan-2-yl]phenyl]-3-(4-phenoxyphenyl)urea
SYSTEMATIC NAME: 1-[3-[4-[4-(hydroxymethyl)phenyl]-6-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]-1,3-dioxan-2-yl]phenyl]-3-(4-phenoxyphenyl)urea
MOLECULAR FORMULA: C44H45N5O6
MOLECULAR WEIGHT: 739.858
SMILES: C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4CC(OC(O4)C5=CC(=CC=C5)NC(=O)NC6=CC=C(C=C6)OC7=CC=CC=C7)C8=CC=C(C=C8)CO
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