N-(4-cyanophenyl)-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-cyanophenyl)-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-(4-cyanophenyl)-1-(4-methylbenzoyl)piperidine-3-carboxamide CAS Name: N-(4-cyanophenyl)-1-[(4-methylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-(4-cyanophenyl)-1-(4-methylbenzoyl)piperidine-3-carboxamide Traditional Name: N-(4-cyanophenyl)-1-p-toluoyl-nipecotamide Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21N3O2/c1-15-4-8-17(9-5-15)21(26)24-12-2-3-18(14-24)20(25)23-19-10-6-16(13-22)7-11-19/h4-11,18H,2-3,12,14H2,1H3,(H,23,25)