ethyl 6-methyl-4-(4-methylphenyl)-2-oxidanylidene-1-[[3-(2-piperidin-1-ylethylcarbamoyl)phenyl]methyl]-3,4-dihydropyridine-5-carboxylate

Systemtic Name: ethyl 6-methyl-4-(4-methylphenyl)-2-oxidanylidene-1-[[3-(2-piperidin-1-ylethylcarbamoyl)phenyl]methyl]-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl 6-methyl-2-oxo-1-[[3-[2-(1-piperidyl)ethylcarbamoyl]phenyl]methyl]-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylate CAS Name: 6-methyl-4-(4-methylphenyl)-2-oxo-1-[[3-[oxo-[2-(1-piperidinyl)ethylamino]methyl]phenyl]methyl]-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-4-(4-methylphenyl)-2-oxo-1-[[3-(2-piperidin-1-ylethylcarbamoyl)phenyl]methyl]-3,4-dihydropyridine-5-carboxylate Traditional Name: 2-keto-6-methyl-1-[3-(2-piperidinoethylcarbamoyl)benzyl]-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=C(C=C2)C)CC3=CC=CC(=C3)C(=O)NCCN4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)CC1C2=CC=C(C=C2)C)CC3=CC=CC(=C3)C(=O)NCCN4CCCCC4)C

InChI

InChI=1S/C31H39N3O4/c1-4-38-31(37)29-23(3)34(28(35)20-27(29)25-13-11-22(2)12-14-25)21-24-9-8-10-26(19-24)30(36)32-15-18-33-16-6-5-7-17-33/h8-14,19,27H,4-7,15-18,20-21H2,1-3H3,(H,32,36)