ethyl 4-methyl-2-oxidanylidene-6-[[4-(phenylcarbonyl)piperidin-1-yl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-oxidanylidene-6-[[4-(phenylcarbonyl)piperidin-1-yl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-benzoyl-1-piperidyl)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(4-benzoyl-1-piperidinyl)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-benzoylpiperidin-1-yl)methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-benzoylpiperidino)methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CN2CCC(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)CN2CCC(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4/c1-3-28-20(26)18-14(2)22-21(27)23-17(18)13-24-11-9-16(10-12-24)19(25)15-7-5-4-6-8-15/h4-8,14,16H,3,9-13H2,1-2H3,(H2,22,23,27)