Monday, February 25, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [(1R)-2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H19NO6
MOLECULAR WEIGHT: 381.37866
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@H](C)C(=O)NC3=CC=CC=C3OC
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Product OPENEYE NAME: benzhydryl-[2-(2-methoxycarbonylanilino)-2-oxo-ethyl]-methyl-ammonium
CAS Name: (diphenylmethyl)-[2-(2-methoxycarbonylanilino)-2-oxoethyl]-methylammonium
IUPAC NAME: benzhydryl-[2-(2-methoxycarbonylanilino)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: (diphenylmethyl)-[2-[(2-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium
MOLECULAR FORMULA: C24H25N2O3+
MOLECULAR WEIGHT: 389.4669
SMILES: C[NH+](CC(=O)NC1=CC=CC=C1C(=O)OC)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl 2-[[2-[benzhydryl(methyl)amino]acetyl]amino]benzoate
CAS Name: 2-[[2-[(diphenylmethyl)-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC NAME: methyl 2-[[2-[benzhydryl(methyl)amino]acetyl]amino]benzoate
SYSTEMATIC NAME: methyl 2-[2-[(diphenylmethyl)-methyl-amino]ethanoylamino]benzoate
MOLECULAR FORMULA: C24H24N2O3
MOLECULAR WEIGHT: 388.45896
SMILES: CN(CC(=O)NC1=CC=CC=C1C(=O)OC)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C19H21NO5
MOLECULAR WEIGHT: 343.37374
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@@H](C)C(=O)NC3CCCC3
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Product OPENEYE NAME: (2S)-N-(2-acetylphenyl)-2-(4-bromo-2-fluoro-phenoxy)propanamide
CAS Name: (2S)-N-(2-acetylphenyl)-2-(4-bromo-2-fluorophenoxy)propanamide
IUPAC NAME: (2S)-N-(2-acetylphenyl)-2-(4-bromo-2-fluorophenoxy)propanamide
SYSTEMATIC NAME: (2S)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(2-ethanoylphenyl)propanamide
MOLECULAR FORMULA: C17H15BrFNO3
MOLECULAR WEIGHT: 380.208303
SMILES: C[C@@H](C(=O)NC1=CC=CC=C1C(=O)C)OC2=C(C=C(C=C2)Br)F
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Product OPENEYE NAME: N-(cyclopentylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-(cyclopentylcarbamoyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(cyclopentylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C19H22N4O2S
MOLECULAR WEIGHT: 370.46858
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC(=O)NC3CCCC3
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Product OPENEYE NAME: [2-(4-acetylanilino)-2-oxo-ethyl]-benzhydryl-methyl-ammonium
CAS Name: [2-(4-acetylanilino)-2-oxoethyl]-(diphenylmethyl)-methylammonium
IUPAC NAME: [2-(4-acetylanilino)-2-oxoethyl]-benzhydryl-methylazanium
SYSTEMATIC NAME: (diphenylmethyl)-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium
MOLECULAR FORMULA: C24H25N2O2+
MOLECULAR WEIGHT: 373.4675
SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: N-(4-acetylphenyl)-2-[benzhydryl(methyl)amino]acetamide
CAS Name: N-(4-acetylphenyl)-2-[(diphenylmethyl)-methylamino]acetamide
IUPAC NAME: N-(4-acetylphenyl)-2-[benzhydryl(methyl)amino]acetamide
SYSTEMATIC NAME: 2-[(diphenylmethyl)-methyl-amino]-N-(4-ethanoylphenyl)ethanamide
MOLECULAR FORMULA: C24H24N2O2
MOLECULAR WEIGHT: 372.45956
SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)CN(C)C(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (2R)-N-(2-acetylphenyl)-2-(4-bromo-2-fluoro-phenoxy)propanamide
CAS Name: (2R)-N-(2-acetylphenyl)-2-(4-bromo-2-fluorophenoxy)propanamide
IUPAC NAME: (2R)-N-(2-acetylphenyl)-2-(4-bromo-2-fluorophenoxy)propanamide
SYSTEMATIC NAME: (2R)-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-(2-ethanoylphenyl)propanamide
MOLECULAR FORMULA: C17H15BrFNO3
MOLECULAR WEIGHT: 380.208303
SMILES: C[C@H](C(=O)NC1=CC=CC=C1C(=O)C)OC2=C(C=C(C=C2)Br)F
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Product OPENEYE NAME: [(1R)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [(2R)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C19H21NO5
MOLECULAR WEIGHT: 343.37374
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)O[C@H](C)C(=O)NC3CCCC3
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Product OPENEYE NAME: benzhydryl-[2-(4-ethoxyanilino)-2-oxo-ethyl]-methyl-ammonium
CAS Name: (diphenylmethyl)-[2-(4-ethoxyanilino)-2-oxoethyl]-methylammonium
IUPAC NAME: benzhydryl-[2-(4-ethoxyanilino)-2-oxoethyl]-methylazanium
SYSTEMATIC NAME: (diphenylmethyl)-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium
MOLECULAR FORMULA: C24H27N2O2+
MOLECULAR WEIGHT: 375.48338
SMILES: CCOC1=CC=C(C=C1)NC(=O)C[NH+](C)C(C2=CC=CC=C2)C3=CC=CC=C3
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