Tuesday, February 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 6-(5-bromo-2-hydroxy-phenyl)-6a,9a-dichloro-2-[4-[2-(2,5-dimethoxyphenyl)vinyl]phenyl]-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6-(5-bromo-2-hydroxyphenyl)-6a,9a-dichloro-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6-(5-bromo-2-hydroxyphenyl)-6a,9a-dichloro-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6-(5-bromanyl-2-oxidanyl-phenyl)-6a,9a-bis(chloranyl)-2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]phenyl]-8-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C42H28BrCl2F5N2O7
MOLECULAR WEIGHT: 918.482936
SMILES: COC1=CC(=C(C=C1)OC)C=CC2=CC=C(C=C2)N3C(=O)C4CC=C5C(C4C3=O)CC6(C(=O)N(C(=O)C6(C5C7=C(C=CC(=C7)Br)O)Cl)C8=C(C(=C(C(=C8F)F)F)F)F)Cl
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Product OPENEYE NAME: 6a,9a-dichloro-6-(2-hydroxy-3-methyl-phenyl)-2-(4-nitrophenyl)-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
CAS Name: 6a,9a-dichloro-6-(2-hydroxy-3-methylphenyl)-2-(4-nitrophenyl)-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC NAME: 6a,9a-dichloro-6-(2-hydroxy-3-methylphenyl)-2-(4-nitrophenyl)-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6a,9a-bis(chloranyl)-6-(3-methyl-2-oxidanyl-phenyl)-2-(4-nitrophenyl)-8-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C33H20Cl2F5N3O7
MOLECULAR WEIGHT: 736.425816
SMILES: CC1=CC=CC(=C1O)C2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=C(C(=C(C(=C6F)F)F)F)F)Cl)Cl)C(=O)N(C4=O)C7=CC=C(C=C7)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[(3,17-dihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl)methyl]-3-isopropyl-1-(1-naphthylmethyl)urea
CAS Name: 1-[(3,17-dihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl)methyl]-1-(1-naphthalenylmethyl)-3-propan-2-ylurea
IUPAC NAME: 1-[(3,17-dihydroxy-10,13-dimethyl-1,2,3,4,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl)methyl]-1-(naphthalen-1-ylmethyl)-3-propan-2-ylurea
SYSTEMATIC NAME: 1-[[10,13-dimethyl-3,17-bis(oxidanyl)-1,2,3,4,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]methyl]-1-(naphthalen-1-ylmethyl)-3-propan-2-yl-urea
MOLECULAR FORMULA: C35H46N2O3
MOLECULAR WEIGHT: 542.75134
SMILES: CC(C)NC(=O)N(CC1=CC=CC2=CC=CC=C21)CC3(CCC4C3(CCC5C4=CC=C6C5(CCC(C6)O)C)C)O
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C43H50F3N3O4
MOLECULAR WEIGHT: 729.87001
SMILES: CC1=CCCC2(C(CCC2(CN3CCC4(CC3)C(=O)NCN4C5=CC=CC=C5)O)C6=C(C=C(CC(CC1)O)C=C6)C(=O)C7=CC(=CC=C7)C(F)(F)F)C
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MOLECULAR FORMULA: C40H43N3O10
MOLECULAR WEIGHT: 725.78352
SMILES: CC(C(C(=O)NCCO)NC(=O)C12CC3C4C(C1ON(C2C(=O)O3)CC5=CC=C(C=C5)C=CCC6=CC=CC=C6O)OC7(O4)CC8=CC=CC=C8C7)O
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MOLECULAR FORMULA: C53H60N4O11
MOLECULAR WEIGHT: 929.0637
SMILES: CC(C)(C)OC(=O)CCC(CO)NC(=O)C(CC1=CC=CC=C1)N(C)C(=O)C23CC4C5C(C2ON(C3C(=O)O4)CC6=CC=CC(=C6)C=CC(=O)N(C)C)OC(O5)(C7=CC=CC=C7)C8=CC=CC=C8
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Product OPENEYE NAME: 3-(4-formyl-2-iodo-6-methoxy-phenoxy)-4-hydroxy-N-(2-hydroxyethyl)-5-(2-morpholinoethylamino)cyclohexene-1-carboxamide
CAS Name: 3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)-5-[2-(4-morpholinyl)ethylamino]-1-cyclohexenecarboxamide
IUPAC NAME: 3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)-5-(2-morpholin-4-ylethylamino)cyclohexene-1-carboxamide
SYSTEMATIC NAME: N-(2-hydroxyethyl)-3-(2-iodanyl-4-methanoyl-6-methoxy-phenoxy)-5-(2-morpholin-4-ylethylamino)-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C23H32IN3O7
MOLECULAR WEIGHT: 589.42055
SMILES: COC1=C(C(=CC(=C1)C=O)I)OC2C=C(CC(C2O)NCCN3CCOCC3)C(=O)NCCO
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Product OPENEYE NAME: 5-[(4-fluorophenyl)methyl-(5-oxohexanoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)cyclohexene-1-carboxamide
CAS Name: 5-[1,5-dioxohexyl-[(4-fluorophenyl)methyl]amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-1-cyclohexenecarboxamide
IUPAC NAME: 5-[(4-fluorophenyl)methyl-(5-oxohexanoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)cyclohexene-1-carboxamide
SYSTEMATIC NAME: 5-[(4-fluorophenyl)methyl-(5-oxidanylidenehexanoyl)amino]-N-(2-hydroxyethyl)-3-(2-iodanylphenoxy)-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C28H32FIN2O6
MOLECULAR WEIGHT: 638.466353
SMILES: CC(=O)CCCC(=O)N(CC1=CC=C(C=C1)F)C2CC(=CC(C2O)OC3=CC=CC=C3I)C(=O)NCCO
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Product OPENEYE NAME: 3-[cyclohexylmethyl(hept-6-enoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
CAS Name: 3-[cyclohexylmethyl(1-oxohept-6-enyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
IUPAC NAME: 3-[cyclohexylmethyl(hept-6-enoyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
SYSTEMATIC NAME: 3-[cyclohexylmethyl(hept-6-enoyl)amino]-N-(2-hydroxyethyl)-4-oxidanyl-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
MOLECULAR FORMULA: C29H40N2O5
MOLECULAR WEIGHT: 496.6383
SMILES: C=CCCCCC(=O)N(CC1CCCCC1)C2C=C(C3C(C2O)OC4=CC=CC=C34)C(=O)NCCO
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Product OPENEYE NAME: N-[5-(4-formyl-2-iodo-6-methoxy-phenoxy)-6-hydroxy-3-(2-hydroxyethylcarbamoyl)cyclohex-3-en-1-yl]-7-methoxy-N-(2-methoxyethyl)benzofuran-2-carboxamide
CAS Name: N-[5-(4-formyl-2-iodo-6-methoxyphenoxy)-6-hydroxy-3-[(2-hydroxyethylamino)-oxomethyl]-1-cyclohex-3-enyl]-7-methoxy-N-(2-methoxyethyl)-2-benzofurancarboxamide
IUPAC NAME: N-[5-(4-formyl-2-iodo-6-methoxyphenoxy)-6-hydroxy-3-(2-hydroxyethylcarbamoyl)cyclohex-3-en-1-yl]-7-methoxy-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: N-[3-(2-hydroxyethylcarbamoyl)-5-(2-iodanyl-4-methanoyl-6-methoxy-phenoxy)-6-oxidanyl-cyclohex-3-en-1-yl]-7-methoxy-N-(2-methoxyethyl)-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C30H33IN2O10
MOLECULAR WEIGHT: 708.49489
SMILES: COCCN(C1CC(=CC(C1O)OC2=C(C=C(C=C2I)C=O)OC)C(=O)NCCO)C(=O)C3=CC4=C(O3)C(=CC=C4)OC
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Product OPENEYE NAME: 5-[(2,4-dichlorophenyl)methyl-(2-methoxyacetyl)amino]-3-(4-formyl-2-iodo-6-methoxy-phenoxy)-4-hydroxy-N-(2-hydroxyethyl)cyclohexene-1-carboxamide
CAS Name: 5-[(2,4-dichlorophenyl)methyl-(2-methoxy-1-oxoethyl)amino]-3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)-1-cyclohexenecarboxamide
IUPAC NAME: 5-[(2,4-dichlorophenyl)methyl-(2-methoxyacetyl)amino]-3-(4-formyl-2-iodo-6-methoxyphenoxy)-4-hydroxy-N-(2-hydroxyethyl)cyclohexene-1-carboxamide
SYSTEMATIC NAME: 5-[(2,4-dichlorophenyl)methyl-(2-methoxyethanoyl)amino]-N-(2-hydroxyethyl)-3-(2-iodanyl-4-methanoyl-6-methoxy-phenoxy)-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C27H29Cl2IN2O8
MOLECULAR WEIGHT: 707.33823
SMILES: COCC(=O)N(CC1=C(C=C(C=C1)Cl)Cl)C2CC(=CC(C2O)OC3=C(C=C(C=C3I)C=O)OC)C(=O)NCCO
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Product OPENEYE NAME: 3-[1-adamantylmethyl(3-cyclopentylpropanoyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
CAS Name: 3-[1-adamantylmethyl-(3-cyclopentyl-1-oxopropyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
IUPAC NAME: 3-[1-adamantylmethyl(3-cyclopentylpropanoyl)amino]-8-formyl-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
SYSTEMATIC NAME: 3-[1-adamantylmethyl(3-cyclopentylpropanoyl)amino]-N-(2-hydroxyethyl)-8-methanoyl-6-methoxy-4-oxidanyl-3,4,4a,9b-tetrahydrodibenzofuran-1-carboxamide
MOLECULAR FORMULA: C36H48N2O7
MOLECULAR WEIGHT: 620.77552
SMILES: COC1=CC(=CC2=C1OC3C2C(=CC(C3O)N(CC45CC6CC(C4)CC(C6)C5)C(=O)CCC7CCCC7)C(=O)NCCO)C=O
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Product OPENEYE NAME: 5-[cyclobutanecarbonyl(2-methoxyethyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodo-6-methoxy-phenoxy]cyclohexene-1-carboxamide
CAS Name: 5-[[cyclobutyl(oxo)methyl]-(2-methoxyethyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodo-6-methoxyphenoxy]-1-cyclohexenecarboxamide
IUPAC NAME: 5-[cyclobutanecarbonyl(2-methoxyethyl)amino]-4-hydroxy-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodo-6-methoxyphenoxy]cyclohexene-1-carboxamide
SYSTEMATIC NAME: 5-[cyclobutylcarbonyl(2-methoxyethyl)amino]-N-(2-hydroxyethyl)-3-[4-(hydroxymethyl)-2-iodanyl-6-methoxy-phenoxy]-4-oxidanyl-cyclohexene-1-carboxamide
MOLECULAR FORMULA: C25H35IN2O8
MOLECULAR WEIGHT: 618.45847
SMILES: COCCN(C1CC(=CC(C1O)OC2=C(C=C(C=C2I)CO)OC)C(=O)NCCO)C(=O)C3CCC3
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