1-[(3-chlorophenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-chlorophenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-chlorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(3-chlorobenzyl)isonipecotic acid Formula: C13H16ClNO2 MolecularWeight: 253.72464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H16ClNO2/c14-12-3-1-2-10(8-12)9-15-6-4-11(5-7-15)13(16)17/h1-3,8,11H,4-7,9H2,(H,16,17)