(3-cyanophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (3-cyanophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (3-cyanobenzyl) ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=CC(=C2)C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=CC(=C2)C#N)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c22-14-16-5-4-6-17(13-16)15-27-20(25)18-9-11-24(12-10-18)21(26)23-19-7-2-1-3-8-19/h1-8,13,18H,9-12,15H2,(H,23,26)