ethyl 1-[6-(3-methylphenyl)-1-(phenylcarbamoyl)piperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[6-(3-methylphenyl)-1-(phenylcarbamoyl)piperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[6-(m-tolyl)-1-(phenylcarbamoyl)piperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[anilino(oxo)methyl]-6-(3-methylphenyl)-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(3-methylphenyl)-1-(phenylcarbamoyl)piperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[6-(m-tolyl)-1-(phenylcarbamoyl)nipecotoyl]nipecotic acid ethyl ester Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCC(N(C2)C(=O)NC3=CC=CC=C3)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCC(N(C2)C(=O)NC3=CC=CC=C3)C4=CC(=CC=C4)C

InChI

InChI=1S/C28H35N3O4/c1-3-35-27(33)23-11-8-16-30(18-23)26(32)22-14-15-25(21-10-7-9-20(2)17-21)31(19-22)28(34)29-24-12-5-4-6-13-24/h4-7,9-10,12-13,17,22-23,25H,3,8,11,14-16,18-19H2,1-2H3,(H,29,34)