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

Systemtic Name: N-butyl-3-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidine-1-carboxamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butyl-5-phenyl-piperidine-1-carboxamide CAS Name: N-butyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-5-phenyl-1-piperidinecarboxamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butyl-5-phenylpiperidine-1-carboxamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butyl-5-phenyl-piperidine-1-carboxamide Formula: C28H38N4O2 MolecularWeight: 462.62692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N4O2/c1-2-3-14-29-28(34)32-21-25(24-12-8-5-9-13-24)19-26(22-32)27(33)31-17-15-30(16-18-31)20-23-10-6-4-7-11-23/h4-13,25-26H,2-3,14-22H2,1H3,(H,29,34)