4-cyano-3-(phenylmethyl)piperidine-1-carboxylic acid

Systemtic Name: 4-cyano-3-(phenylmethyl)piperidine-1-carboxylic acid Openeye Name: 3-benzyl-4-cyano-piperidine-1-carboxylic acid CAS Name: 4-cyano-3-(phenylmethyl)-1-piperidinecarboxylic acid IUPAC Name: 3-benzyl-4-cyanopiperidine-1-carboxylic acid Traditional Name: 3-benzyl-4-cyano-piperidine-1-carboxylic acid Formula: C14H16N2O2 MolecularWeight: 244.28904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C#N)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CN(CC(C1C#N)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H16N2O2/c15-9-12-6-7-16(14(17)18)10-13(12)8-11-4-2-1-3-5-11/h1-5,12-13H,6-8,10H2,(H,17,18)