Thursday, February 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [2-[2-[(1R)-1-methylpropyl]anilino]-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] ester
IUPAC NAME: [2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[[2-[(2R)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C24H28N2O4
MOLECULAR WEIGHT: 408.49012
SMILES: CC[C@@H](C)C1=CC=CC=C1NC(=O)COC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(propylamino)ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-oxo-1-(propylamino)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(propylamino)propan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CCCNC(=O)[C@@H](C)OC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C20H21NO4
MOLECULAR WEIGHT: 339.38504
SMILES: CCCNC(=O)[C@H](C)OC(=O)C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
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Product OPENEYE NAME: [2-[2-[(1S)-1-methylpropyl]anilino]-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-[2-[(2S)-butan-2-yl]anilino]-2-oxoethyl] ester
IUPAC NAME: [2-[2-[(2S)-butan-2-yl]anilino]-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[[2-[(2S)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C24H28N2O4
MOLECULAR WEIGHT: 408.49012
SMILES: CC[C@H](C)C1=CC=CC=C1NC(=O)COC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C
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Product OPENEYE NAME: [(1S)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(cycloheptylamino)-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C24H27NO4
MOLECULAR WEIGHT: 393.47548
SMILES: C[C@@H](C(=O)NC1CCCCCC1)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [(1R)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(cycloheptylamino)-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C24H27NO4
MOLECULAR WEIGHT: 393.47548
SMILES: C[C@H](C(=O)NC1CCCCCC1)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester
IUPAC NAME: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C23H26N2O4
MOLECULAR WEIGHT: 394.46354
SMILES: CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C
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Product OPENEYE NAME: [(1S)-2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C25H23NO5
MOLECULAR WEIGHT: 417.45382
SMILES: C[C@@H](C(=O)NCC1=CC=CC=C1OC)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester
IUPAC NAME: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C22H24N2O6
MOLECULAR WEIGHT: 412.43576
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)NC3=CC(=C(C=C3)OC)OC
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Product OPENEYE NAME: [(1R)-2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C25H23NO5
MOLECULAR WEIGHT: 417.45382
SMILES: C[C@H](C(=O)NCC1=CC=CC=C1OC)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [(1S)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C24H20FNO4
MOLECULAR WEIGHT: 405.418303
SMILES: C[C@@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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Product OPENEYE NAME: [2-(2-methylsulfanylanilino)-2-oxo-ethyl] 1-(2-furylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
CAS Name: 1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-[2-(methylthio)anilino]-2-oxoethyl] ester
IUPAC NAME: [2-(2-methylsulfanylanilino)-2-oxoethyl] 1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxylate
SYSTEMATIC NAME: [2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrole-3-carboxylate
MOLECULAR FORMULA: C21H22N2O4S
MOLECULAR WEIGHT: 398.47538
SMILES: CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)OCC(=O)NC3=CC=CC=C3SC
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Product OPENEYE NAME: [(1R)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 4-benzoylbenzoate
CAS Name: 4-benzoylbenzoic acid [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 4-benzoylbenzoate
SYSTEMATIC NAME: [(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 4-(phenylcarbonyl)benzoate
MOLECULAR FORMULA: C24H20FNO4
MOLECULAR WEIGHT: 405.418303
SMILES: C[C@H](C(=O)NCC1=CC=C(C=C1)F)OC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
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