methyl 1-[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(2-cyanoanilino)-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[2-(2-cyanoanilino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2-cyanoanilino)-2-oxoethyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2-cyanoanilino)-2-keto-ethyl]isonipecotic acid methyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)CC(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

COC(=O)C1CCN(CC1)CC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C16H19N3O3/c1-22-16(21)12-6-8-19(9-7-12)11-15(20)18-14-5-3-2-4-13(14)10-17/h2-5,12H,6-9,11H2,1H3,(H,18,20)