Thursday, July 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 3,5-bis(3,4-dimethoxyphenyl)-2,2-dimethyl-furan-1-ium
CAS Name: 3,5-bis(3,4-dimethoxyphenyl)-2,2-dimethylfuran-1-ium
IUPAC NAME: 3,5-bis(3,4-dimethoxyphenyl)-2,2-dimethylfuran-1-ium
SYSTEMATIC NAME: 3,5-bis(3,4-dimethoxyphenyl)-2,2-dimethyl-furan-1-ium
MOLECULAR FORMULA: C22H25O5+
MOLECULAR WEIGHT: 369.4309
SMILES: CC1(C(=CC(=[O+]1)C2=CC(=C(C=C2)OC)OC)C3=CC(=C(C=C3)OC)OC)C
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Product OPENEYE NAME: 2,4-bis(3,4-dimethoxyphenyl)-5,5-dimethyl-furan-2-ol
CAS Name: 2,4-bis(3,4-dimethoxyphenyl)-5,5-dimethyl-2-furanol
IUPAC NAME: 2,4-bis(3,4-dimethoxyphenyl)-5,5-dimethylfuran-2-ol
SYSTEMATIC NAME: 2,4-bis(3,4-dimethoxyphenyl)-5,5-dimethyl-furan-2-ol
MOLECULAR FORMULA: C22H26O6
MOLECULAR WEIGHT: 386.43824
SMILES: CC1(C(=CC(O1)(C2=CC(=C(C=C2)OC)OC)O)C3=CC(=C(C=C3)OC)OC)C
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Product OPENEYE NAME: (8S,18R)-8,18-diphenyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
CAS Name: (8S,18R)-8,18-diphenyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
IUPAC NAME: (8S,18R)-8,18-diphenyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
SYSTEMATIC NAME: (8S,18R)-8,18-diphenyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
MOLECULAR FORMULA: C24H28O8
MOLECULAR WEIGHT: 444.47432
SMILES: C1COC[C@@H](OC(=O)COCC(=O)O[C@@H](COCCO1)C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15-pentaoxa-21-azabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione
CAS Name: (4R,14S)-4,14-diphenyl-3,6,9,12,15-pentaoxa-21-azabicyclo[15.3.1]heneicosa-1(21),17,19-triene-2,16-dione
IUPAC NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15-pentaoxa-21-azabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione
SYSTEMATIC NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15-pentaoxa-21-azabicyclo[15.3.1]henicosa-1(21),17,19-triene-2,16-dione
MOLECULAR FORMULA: C27H27NO7
MOLECULAR WEIGHT: 477.50578
SMILES: C1COC[C@H](OC(=O)C2=NC(=CC=C2)C(=O)O[C@H](COCCO1)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15,20-hexaoxabicyclo[15.2.1]icosa-1(19),17-diene-2,16-dione
CAS Name: (4R,14S)-4,14-diphenyl-3,6,9,12,15,20-hexaoxabicyclo[15.2.1]eicosa-1(19),17-diene-2,16-dione
IUPAC NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15,20-hexaoxabicyclo[15.2.1]icosa-1(19),17-diene-2,16-dione
SYSTEMATIC NAME: (4R,14S)-4,14-diphenyl-3,6,9,12,15,20-hexaoxabicyclo[15.2.1]icosa-1(19),17-diene-2,16-dione
MOLECULAR FORMULA: C26H26O8
MOLECULAR WEIGHT: 466.47984
SMILES: C1COC[C@@H](OC(=O)C2=CC=C(O2)C(=O)O[C@@H](COCCO1)C3=CC=CC=C3)C4=CC=CC=C4
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Product OPENEYE NAME: [(Z)-[(E)-1-benzoyl-3-(4-chlorophenyl)prop-2-enylidene]amino]thiourea
CAS Name: [(Z)-[(E)-4-(4-chlorophenyl)-1-oxo-1-phenylbut-3-en-2-ylidene]amino]thiourea
IUPAC NAME: [(Z)-[(E)-4-(4-chlorophenyl)-1-oxo-1-phenylbut-3-en-2-ylidene]amino]thiourea
SYSTEMATIC NAME: 1-[(Z)-[(E)-4-(4-chlorophenyl)-1-oxidanylidene-1-phenyl-but-3-en-2-ylidene]amino]thiourea
MOLECULAR FORMULA: C17H14ClN3OS
MOLECULAR WEIGHT: 343.83056
SMILES: C1=CC=C(C=C1)C(=O)/C(=N\NC(=S)N)/C=C/C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: (Z)-4-[2-(1H-perimidin-2-yl)hydrazino]pent-3-en-2-one
CAS Name: (Z)-4-(1H-perimidin-2-ylhydrazo)-3-penten-2-one
IUPAC NAME: (Z)-4-[2-(1H-perimidin-2-yl)hydrazinyl]pent-3-en-2-one
SYSTEMATIC NAME: (Z)-4-[2-(1H-perimidin-2-yl)hydrazinyl]pent-3-en-2-one
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: C/C(=C/C(=O)C)/NNC1=NC2=CC=CC3=C2C(=CC=C3)N1
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Product OPENEYE NAME: 2,2-dimethyl-6-[2-(methylamino)benzoyl]-7,8-dihydro-6H-chromen-5-one
CAS Name: 2,2-dimethyl-6-[[2-(methylamino)phenyl]-oxomethyl]-7,8-dihydro-6H-1-benzopyran-5-one
IUPAC NAME: 2,2-dimethyl-6-[2-(methylamino)benzoyl]-7,8-dihydro-6H-chromen-5-one
SYSTEMATIC NAME: 2,2-dimethyl-6-[2-(methylamino)phenyl]carbonyl-7,8-dihydro-6H-chromen-5-one
MOLECULAR FORMULA: C19H21NO3
MOLECULAR WEIGHT: 311.37494
SMILES: CC1(C=CC2=C(O1)CCC(C2=O)C(=O)C3=CC=CC=C3NC)C
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Product OPENEYE NAME: 3,3,12-trimethyl-5,6-dihydropyrano[2,3-c]acridin-7-one
CAS Name: 3,3,12-trimethyl-5,6-dihydropyrano[2,3-c]acridin-7-one
IUPAC NAME: 3,3,12-trimethyl-5,6-dihydropyrano[2,3-c]acridin-7-one
SYSTEMATIC NAME: 3,3,12-trimethyl-5,6-dihydropyrano[2,3-c]acridin-7-one
MOLECULAR FORMULA: C19H19NO2
MOLECULAR WEIGHT: 293.35966
SMILES: CC1(C=CC2=C(O1)CCC3=C2N(C4=CC=CC=C4C3=O)C)C
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Product OPENEYE NAME: 1-methyl-3-(1-methylpyridin-1-ium-3-yl)sulfanyl-pyridin-1-ium
CAS Name: 1-methyl-3-[(1-methyl-3-pyridin-1-iumyl)thio]pyridin-1-ium
IUPAC NAME: 1-methyl-3-(1-methylpyridin-1-ium-3-yl)sulfanylpyridin-1-ium
SYSTEMATIC NAME: 1-methyl-3-(1-methylpyridin-1-ium-3-yl)sulfanyl-pyridin-1-ium
MOLECULAR FORMULA: C12H14N2S+2
MOLECULAR WEIGHT: 218.31796
SMILES: C[N+]1=CC=CC(=C1)SC2=C[N+](=CC=C2)C
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Product OPENEYE NAME: [4-benzhydryl-3-(4-chlorophenyl)-5H-1,2,4-oxadiazol-5-yl]-phenyl-methanol
CAS Name: [3-(4-chlorophenyl)-4-(diphenylmethyl)-5H-1,2,4-oxadiazol-5-yl]-phenylmethanol
IUPAC NAME: [4-benzhydryl-3-(4-chlorophenyl)-5H-1,2,4-oxadiazol-5-yl]-phenylmethanol
SYSTEMATIC NAME: [3-(4-chlorophenyl)-4-(diphenylmethyl)-5H-1,2,4-oxadiazol-5-yl]-phenyl-methanol
MOLECULAR FORMULA: C28H23ClN2O2
MOLECULAR WEIGHT: 454.94742
SMILES: C1=CC=C(C=C1)C(C2N(C(=NO2)C3=CC=C(C=C3)Cl)C(C4=CC=CC=C4)C5=CC=CC=C5)O
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