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

Systemtic Name: 4-oxidanylidene-1-(phenylmethyl)piperidine-3-carboxylic acid Openeye Name: 1-benzyl-4-oxo-piperidine-3-carboxylic acid CAS Name: 4-oxo-1-(phenylmethyl)-3-piperidinecarboxylic acid IUPAC Name: 1-benzyl-4-oxopiperidine-3-carboxylic acid Traditional Name: 1-benzyl-4-keto-nipecotic acid Formula: C13H15NO3 MolecularWeight: 233.2631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1=O)C(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CC(C1=O)C(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C13H15NO3/c15-12-6-7-14(9-11(12)13(16)17)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,16,17)