Monday, January 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: ethyl 4-[(2-hydroxy-4-methyl-phenyl)carbamoyl]piperidine-1-carboxylate
CAS Name: 4-[(2-hydroxy-4-methylanilino)-oxomethyl]-1-piperidinecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4-[(2-hydroxy-4-methylphenyl)carbamoyl]piperidine-1-carboxylate
SYSTEMATIC NAME: ethyl 4-[(4-methyl-2-oxidanyl-phenyl)carbamoyl]piperidine-1-carboxylate
MOLECULAR FORMULA: C16H22N2O4
MOLECULAR WEIGHT: 306.35688
SMILES: CCOC(=O)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)C)O
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Product OPENEYE NAME: methyl 1-[2-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
CAS Name: 1-[2-(4-methylphenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H23NO4
MOLECULAR WEIGHT: 305.36882
SMILES: CC1=CC=C(C=C1)OC(C)C(=O)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[3-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
CAS Name: 1-[3-(4-methylphenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[3-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[3-(4-methylphenoxy)propanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H23NO4
MOLECULAR WEIGHT: 305.36882
SMILES: CC1=CC=C(C=C1)OCCC(=O)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[2-(2,6-dimethylphenoxy)acetyl]piperidine-4-carboxylate
CAS Name: 1-[2-(2,6-dimethylphenoxy)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-(2,6-dimethylphenoxy)acetyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-(2,6-dimethylphenoxy)ethanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H23NO4
MOLECULAR WEIGHT: 305.36882
SMILES: CC1=C(C(=CC=C1)C)OCC(=O)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-4-carboxylate
CAS Name: 1-[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(E)-3-(4-cyanophenyl)prop-2-enoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H18N2O3
MOLECULAR WEIGHT: 298.33642
SMILES: COC(=O)C1CCN(CC1)C(=O)/C=C/C2=CC=C(C=C2)C#N
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Product OPENEYE NAME: methyl 1-[3-(trifluoromethyl)benzoyl]piperidine-4-carboxylate
CAS Name: 1-[oxo-[3-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[3-(trifluoromethyl)benzoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[3-(trifluoromethyl)phenyl]carbonylpiperidine-4-carboxylate
MOLECULAR FORMULA: C15H16F3NO3
MOLECULAR WEIGHT: 315.28765
SMILES: COC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)C(F)(F)F
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Product OPENEYE NAME: methyl 1-[4-(3-methylphenoxy)butanoyl]piperidine-4-carboxylate
CAS Name: 1-[4-(3-methylphenoxy)-1-oxobutyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[4-(3-methylphenoxy)butanoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[4-(3-methylphenoxy)butanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1=CC(=CC=C1)OCCCC(=O)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: methyl 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylate
CAS Name: 1-[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H21NO4
MOLECULAR WEIGHT: 303.35294
SMILES: COC1=CC=CC(=C1)/C=C/C(=O)N2CCC(CC2)C(=O)OC
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Product OPENEYE NAME: 6-oxo-1-propyl-N-(2,2,2-trifluoroethyl)pyridazine-3-carboxamide
CAS Name: 6-oxo-1-propyl-N-(2,2,2-trifluoroethyl)-3-pyridazinecarboxamide
IUPAC NAME: 6-oxo-1-propyl-N-(2,2,2-trifluoroethyl)pyridazine-3-carboxamide
SYSTEMATIC NAME: 6-oxidanylidene-1-propyl-N-[2,2,2-tris(fluoranyl)ethyl]pyridazine-3-carboxamide
MOLECULAR FORMULA: C10H12F3N3O2
MOLECULAR WEIGHT: 263.21639
SMILES: CCCN1C(=O)C=CC(=N1)C(=O)NCC(F)(F)F
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Product OPENEYE NAME: N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CAS Name: N-(2,2,2-trifluoroethyl)-4-pyridinecarboxamide
IUPAC NAME: N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
SYSTEMATIC NAME: N-[2,2,2-tris(fluoranyl)ethyl]pyridine-4-carboxamide
MOLECULAR FORMULA: C8H7F3N2O
MOLECULAR WEIGHT: 204.14919
SMILES: C1=CN=CC=C1C(=O)NCC(F)(F)F
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Product OPENEYE NAME: 2-(2-thienyl)-N-(2,2,2-trifluoroethyl)acetamide
CAS Name: 2-thiophen-2-yl-N-(2,2,2-trifluoroethyl)acetamide
IUPAC NAME: 2-thiophen-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SYSTEMATIC NAME: 2-thiophen-2-yl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide
MOLECULAR FORMULA: C8H8F3NOS
MOLECULAR WEIGHT: 223.21543
SMILES: C1=CSC(=C1)CC(=O)NCC(F)(F)F
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Product OPENEYE NAME: ethyl 4-[(4-amino-4-oxo-butyl)sulfamoyl]benzoate
CAS Name: 4-[(4-amino-4-oxobutyl)sulfamoyl]benzoic acid ethyl ester
IUPAC NAME: ethyl 4-[(4-amino-4-oxobutyl)sulfamoyl]benzoate
SYSTEMATIC NAME: ethyl 4-[(4-azanyl-4-oxidanylidene-butyl)sulfamoyl]benzoate
MOLECULAR FORMULA: C13H18N2O5S
MOLECULAR WEIGHT: 314.35742
SMILES: CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)N
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Product OPENEYE NAME: N'-[(2E,4E)-hexa-2,4-dienoyl]-3-methyl-4-oxo-phthalazine-1-carbohydrazide
CAS Name: 3-methyl-4-oxo-N'-[(2E,4E)-1-oxohexa-2,4-dienyl]-1-phthalazinecarbohydrazide
IUPAC NAME: N'-[(2E,4E)-hexa-2,4-dienoyl]-3-methyl-4-oxophthalazine-1-carbohydrazide
SYSTEMATIC NAME: N'-[(2E,4E)-hexa-2,4-dienoyl]-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide
MOLECULAR FORMULA: C16H16N4O3
MOLECULAR WEIGHT: 312.32324
SMILES: C/C=C/C=C/C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C
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Product OPENEYE NAME: (2E,4E)-N-[(4-methoxyphenyl)methyl]-N-methyl-hexa-2,4-dienamide
CAS Name: (2E,4E)-N-[(4-methoxyphenyl)methyl]-N-methylhexa-2,4-dienamide
IUPAC NAME: (2E,4E)-N-[(4-methoxyphenyl)methyl]-N-methylhexa-2,4-dienamide
SYSTEMATIC NAME: (2E,4E)-N-[(4-methoxyphenyl)methyl]-N-methyl-hexa-2,4-dienamide
MOLECULAR FORMULA: C15H19NO2
MOLECULAR WEIGHT: 245.31686
SMILES: C/C=C/C=C/C(=O)N(C)CC1=CC=C(C=C1)OC
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