N-[(E)-(4-methylphenyl)methylideneamino]-1-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[(E)-(4-methylphenyl)methylideneamino]-1-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-benzyl-N-[(E)-p-tolylmethyleneamino]piperidine-4-carboxamide CAS Name: N-[(E)-(4-methylphenyl)methylideneamino]-1-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-benzyl-N-[(E)-(4-methylphenyl)methylideneamino]piperidine-4-carboxamide Traditional Name: 1-benzyl-N-[(E)-(4-methylbenzylidene)amino]isonipecotamide Formula: C21H25N3O MolecularWeight: 335.4427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC(=O)C2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC(=O)C2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O/c1-17-7-9-18(10-8-17)15-22-23-21(25)20-11-13-24(14-12-20)16-19-5-3-2-4-6-19/h2-10,15,20H,11-14,16H2,1H3,(H,23,25)/b22-15+