1-(2-oxidanylidene-3,3-diphenyl-propyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(2-oxidanylidene-3,3-diphenyl-propyl)piperidine-3-carboxylic acid Openeye Name: 1-(2-oxo-3,3-diphenyl-propyl)piperidine-3-carboxylic acid CAS Name: 1-(2-oxo-3,3-diphenylpropyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(2-oxo-3,3-diphenylpropyl)piperidine-3-carboxylic acid Traditional Name: 1-(2-keto-3,3-diphenyl-propyl)nipecotic acid Formula: C21H23NO3 MolecularWeight: 337.41222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

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