Wednesday, June 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H17N3O2
MOLECULAR WEIGHT: 343.37858
SMILES: C1C2C3=CC=CN3C4=CC=CC=C4CN2C(=O)N(C1=O)C5=CC=CC=C5
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Product OPENEYE NAME: methyl 3-oxo-3-[(2-pyrrol-1-ylphenyl)methylamino]propanoate
CAS Name: 3-oxo-3-[[2-(1-pyrrolyl)phenyl]methylamino]propanoic acid methyl ester
IUPAC NAME: methyl 3-oxo-3-[(2-pyrrol-1-ylphenyl)methylamino]propanoate
SYSTEMATIC NAME: methyl 3-oxidanylidene-3-[(2-pyrrol-1-ylphenyl)methylamino]propanoate
MOLECULAR FORMULA: C15H16N2O3
MOLECULAR WEIGHT: 272.29914
SMILES: COC(=O)CC(=O)NCC1=CC=CC=C1N2C=CC=C2
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Product OPENEYE NAME: 3-(2-hydroxyethyl)-5-phenyl-1,3,4-oxadiazol-2-one
CAS Name: 3-(2-hydroxyethyl)-5-phenyl-1,3,4-oxadiazol-2-one
IUPAC NAME: 3-(2-hydroxyethyl)-5-phenyl-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-5-phenyl-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C10H10N2O3
MOLECULAR WEIGHT: 206.198
SMILES: C1=CC=C(C=C1)C2=NN(C(=O)O2)CCO
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Product OPENEYE NAME: 3-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-one
CAS Name: 3-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-one
IUPAC NAME: 3-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C11H12N2O4
MOLECULAR WEIGHT: 236.22398
SMILES: COC1=CC=C(C=C1)C2=NN(C(=O)O2)CCO
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Product OPENEYE NAME: 3-(2-hydroxyethyl)-5-(p-tolyl)-1,3,4-oxadiazol-2-one
CAS Name: 3-(2-hydroxyethyl)-5-(4-methylphenyl)-1,3,4-oxadiazol-2-one
IUPAC NAME: 3-(2-hydroxyethyl)-5-(4-methylphenyl)-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-5-(4-methylphenyl)-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: CC1=CC=C(C=C1)C2=NN(C(=O)O2)CCO
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Product OPENEYE NAME: 5-(4-chlorophenyl)-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
CAS Name: 5-(4-chlorophenyl)-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
IUPAC NAME: 5-(4-chlorophenyl)-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 5-(4-chlorophenyl)-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C10H9ClN2O3
MOLECULAR WEIGHT: 240.64306
SMILES: C1=CC(=CC=C1C2=NN(C(=O)O2)CCO)Cl
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Product OPENEYE NAME: 5-benzyl-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
CAS Name: 3-(2-hydroxyethyl)-5-(phenylmethyl)-1,3,4-oxadiazol-2-one
IUPAC NAME: 5-benzyl-3-(2-hydroxyethyl)-1,3,4-oxadiazol-2-one
SYSTEMATIC NAME: 3-(2-hydroxyethyl)-5-(phenylmethyl)-1,3,4-oxadiazol-2-one
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: C1=CC=C(C=C1)CC2=NN(C(=O)O2)CCO
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Product OPENEYE NAME: 4-methoxy-N-(2-oxooxazolidin-3-yl)benzamide
CAS Name: 4-methoxy-N-(2-oxo-3-oxazolidinyl)benzamide
IUPAC NAME: 4-methoxy-N-(2-oxo-1,3-oxazolidin-3-yl)benzamide
SYSTEMATIC NAME: 4-methoxy-N-(2-oxidanylidene-1,3-oxazolidin-3-yl)benzamide
MOLECULAR FORMULA: C11H12N2O4
MOLECULAR WEIGHT: 236.22398
SMILES: COC1=CC=C(C=C1)C(=O)NN2CCOC2=O
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Product OPENEYE NAME: 4-methyl-N-(2-oxooxazolidin-3-yl)benzamide
CAS Name: 4-methyl-N-(2-oxo-3-oxazolidinyl)benzamide
IUPAC NAME: 4-methyl-N-(2-oxo-1,3-oxazolidin-3-yl)benzamide
SYSTEMATIC NAME: 4-methyl-N-(2-oxidanylidene-1,3-oxazolidin-3-yl)benzamide
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: CC1=CC=C(C=C1)C(=O)NN2CCOC2=O
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Product OPENEYE NAME: 4-chloro-N-(2-oxooxazolidin-3-yl)benzamide
CAS Name: 4-chloro-N-(2-oxo-3-oxazolidinyl)benzamide
IUPAC NAME: 4-chloro-N-(2-oxo-1,3-oxazolidin-3-yl)benzamide
SYSTEMATIC NAME: 4-chloranyl-N-(2-oxidanylidene-1,3-oxazolidin-3-yl)benzamide
MOLECULAR FORMULA: C10H9ClN2O3
MOLECULAR WEIGHT: 240.64306
SMILES: C1COC(=O)N1NC(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: N-(2-oxooxazolidin-3-yl)-2-phenyl-acetamide
CAS Name: N-(2-oxo-3-oxazolidinyl)-2-phenylacetamide
IUPAC NAME: N-(2-oxo-1,3-oxazolidin-3-yl)-2-phenylacetamide
SYSTEMATIC NAME: N-(2-oxidanylidene-1,3-oxazolidin-3-yl)-2-phenyl-ethanamide
MOLECULAR FORMULA: C11H12N2O3
MOLECULAR WEIGHT: 220.22458
SMILES: C1COC(=O)N1NC(=O)CC2=CC=CC=C2
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Product OPENEYE NAME: ethyl (4S,5R)-3-benzamido-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-benzamido-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-benzamido-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-benzamido-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C19H18N2O5
MOLECULAR WEIGHT: 354.35662
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5R)-3-[(4-methoxybenzoyl)amino]-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-[[(4-methoxyphenyl)-oxomethyl]amino]-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-[(4-methoxybenzoyl)amino]-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-[(4-methoxyphenyl)carbonylamino]-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C20H20N2O6
MOLECULAR WEIGHT: 384.3826
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5R)-3-[(4-methylbenzoyl)amino]-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-[[(4-methylphenyl)-oxomethyl]amino]-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-[(4-methylbenzoyl)amino]-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-[(4-methylphenyl)carbonylamino]-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C20H20N2O5
MOLECULAR WEIGHT: 368.3832
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5R)-3-[(4-nitrobenzoyl)amino]-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-[[(4-nitrophenyl)-oxomethyl]amino]-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-[(4-nitrobenzoyl)amino]-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-[(4-nitrophenyl)carbonylamino]-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C19H17N3O7
MOLECULAR WEIGHT: 399.35418
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5R)-3-benzamido-5-(4-nitrophenyl)-2-oxo-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-benzamido-5-(4-nitrophenyl)-2-oxo-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-benzamido-5-(4-nitrophenyl)-2-oxo-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-benzamido-5-(4-nitrophenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C19H17N3O7
MOLECULAR WEIGHT: 399.35418
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl (4S,5R)-3-[(4-methylbenzoyl)amino]-5-(4-nitrophenyl)-2-oxo-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-[[(4-methylphenyl)-oxomethyl]amino]-5-(4-nitrophenyl)-2-oxo-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-[(4-methylbenzoyl)amino]-5-(4-nitrophenyl)-2-oxo-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-[(4-methylphenyl)carbonylamino]-5-(4-nitrophenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C20H19N3O7
MOLECULAR WEIGHT: 413.38076
SMILES: CCOC(=O)[C@@H]1[C@H](OC(=O)N1NC(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)[N+](=O)[O-]
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Product OPENEYE NAME: ethyl (4S,5R)-3-benzamido-5-methyl-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-3-benzamido-5-methyl-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-3-benzamido-5-methyl-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-3-benzamido-5-methyl-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C20H20N2O5
MOLECULAR WEIGHT: 368.3832
SMILES: CCOC(=O)[C@@H]1[C@@](OC(=O)N1NC(=O)C2=CC=CC=C2)(C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5R)-5-methyl-3-[(4-methylbenzoyl)amino]-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5R)-5-methyl-3-[[(4-methylphenyl)-oxomethyl]amino]-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5R)-5-methyl-3-[(4-methylbenzoyl)amino]-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5R)-5-methyl-3-[(4-methylphenyl)carbonylamino]-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C21H22N2O5
MOLECULAR WEIGHT: 382.40978
SMILES: CCOC(=O)[C@@H]1[C@@](OC(=O)N1NC(=O)C2=CC=C(C=C2)C)(C)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5S)-3-benzamido-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5S)-3-benzamido-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5S)-3-benzamido-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5S)-3-benzamido-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C19H18N2O5
MOLECULAR WEIGHT: 354.35662
SMILES: CCOC(=O)[C@@H]1[C@@H](OC(=O)N1NC(=O)C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5S)-3-[(4-methoxybenzoyl)amino]-2-oxo-5-phenyl-oxazolidine-4-carboxylate
CAS Name: (4S,5S)-3-[[(4-methoxyphenyl)-oxomethyl]amino]-2-oxo-5-phenyl-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5S)-3-[(4-methoxybenzoyl)amino]-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5S)-3-[(4-methoxyphenyl)carbonylamino]-2-oxidanylidene-5-phenyl-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C20H20N2O6
MOLECULAR WEIGHT: 384.3826
SMILES: CCOC(=O)[C@@H]1[C@@H](OC(=O)N1NC(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl (4S,5S)-3-benzamido-5-(4-nitrophenyl)-2-oxo-oxazolidine-4-carboxylate
CAS Name: (4S,5S)-3-benzamido-5-(4-nitrophenyl)-2-oxo-4-oxazolidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl (4S,5S)-3-benzamido-5-(4-nitrophenyl)-2-oxo-1,3-oxazolidine-4-carboxylate
SYSTEMATIC NAME: ethyl (4S,5S)-3-benzamido-5-(4-nitrophenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylate
MOLECULAR FORMULA: C19H17N3O7
MOLECULAR WEIGHT: 399.35418
SMILES: CCOC(=O)[C@@H]1[C@@H](OC(=O)N1NC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]
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