4-methanoyl-1,3-bis(phenylmethyl)piperidine-3-carboxylic acid

Systemtic Name: 4-methanoyl-1,3-bis(phenylmethyl)piperidine-3-carboxylic acid Openeye Name: 1,3-dibenzyl-4-formyl-piperidine-3-carboxylic acid CAS Name: 4-formyl-1,3-bis(phenylmethyl)-3-piperidinecarboxylic acid IUPAC Name: 1,3-dibenzyl-4-formylpiperidine-3-carboxylic acid Traditional Name: 1,3-dibenzyl-4-formyl-nipecotic acid Formula: C21H23NO3 MolecularWeight: 337.41222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1C=O)(CC2=CC=CC=C2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC(C1C=O)(CC2=CC=CC=C2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c23-15-19-11-12-22(14-18-9-5-2-6-10-18)16-21(19,20(24)25)13-17-7-3-1-4-8-17/h1-10,15,19H,11-14,16H2,(H,24,25)