[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)NCCC#N)C(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)NCCC#N)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O4/c19-9-4-10-20-16(23)13-26-17(24)14-7-11-22(12-8-14)18(25)21-15-5-2-1-3-6-15/h1-3,5-6,14H,4,7-8,10-13H2,(H,20,23)(H,21,25)