N-ethyl-3-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidine-1-carboxamide

Systemtic Name: N-ethyl-3-(3-methylphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidine-1-carboxamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-N-ethyl-5-(m-tolyl)piperidine-1-carboxamide CAS Name: N-ethyl-3-(3-methylphenyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-piperidinecarboxamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-N-ethyl-5-(3-methylphenyl)piperidine-1-carboxamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-N-ethyl-5-(m-tolyl)piperidine-1-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CC(CC(C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC(=CC=C4)C

Isomeric SMILES

CCNC(=O)N1CC(CC(C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC(=CC=C4)C

InChI

InChI=1S/C27H36N4O2/c1-3-28-27(33)31-19-24(23-11-7-8-21(2)16-23)17-25(20-31)26(32)30-14-12-29(13-15-30)18-22-9-5-4-6-10-22/h4-11,16,24-25H,3,12-15,17-20H2,1-2H3,(H,28,33)