N-butan-2-yl-1-[3-[(4-methylphenyl)carbonylamino]phenyl]carbonyl-piperidine-3-carboxamide

Systemtic Name: N-butan-2-yl-1-[3-[(4-methylphenyl)carbonylamino]phenyl]carbonyl-piperidine-3-carboxamide Openeye Name: 1-[3-[(4-methylbenzoyl)amino]benzoyl]-N-sec-butyl-piperidine-3-carboxamide CAS Name: N-butan-2-yl-1-[[3-[[(4-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-butan-2-yl-1-[3-[(4-methylbenzoyl)amino]benzoyl]piperidine-3-carboxamide Traditional Name: 1-[3-(p-toluoylamino)benzoyl]-N-sec-butyl-nipecotamide Formula: C25H31N3O3 MolecularWeight: 421.53194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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