N-butyl-1-[3-[(4-methylphenyl)carbonylamino]phenyl]carbonyl-piperidine-3-carboxamide

Systemtic Name: N-butyl-1-[3-[(4-methylphenyl)carbonylamino]phenyl]carbonyl-piperidine-3-carboxamide Openeye Name: N-butyl-1-[3-[(4-methylbenzoyl)amino]benzoyl]piperidine-3-carboxamide CAS Name: N-butyl-1-[[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-butyl-1-[3-[(4-methylbenzoyl)amino]benzoyl]piperidine-3-carboxamide Traditional Name: N-butyl-1-[3-(p-toluoylamino)benzoyl]nipecotamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H31N3O3/c1-3-4-14-26-23(29)21-8-6-15-28(17-21)25(31)20-7-5-9-22(16-20)27-24(30)19-12-10-18(2)11-13-19/h5,7,9-13,16,21H,3-4,6,8,14-15,17H2,1-2H3,(H,26,29)(H,27,30)