1-[2-[2-cyanoethyl-(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[2-cyanoethyl-(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-[N-(2-cyanoethyl)-3,5-dimethyl-anilino]-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[2-[N-(2-cyanoethyl)-3,5-dimethylanilino]-2-oxoethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-[N-(2-cyanoethyl)-3,5-dimethylanilino]-2-oxoethyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-[N-(2-cyanoethyl)-3,5-dimethyl-anilino]-2-keto-ethyl]isonipecotamide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2CCC(CC2)C(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2CCC(CC2)C(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C26H32N4O2/c1-20-15-21(2)17-24(16-20)30(12-6-11-27)25(31)19-29-13-9-23(10-14-29)26(32)28-18-22-7-4-3-5-8-22/h3-5,7-8,15-17,23H,6,9-10,12-14,18-19H2,1-2H3,(H,28,32)