1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperidine-3-carboxylic acid hydrochloride

Systemtic Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperidine-3-carboxylic acid hydrochloride Openeye Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]piperidine-3-carboxylic acid hydrochloride CAS Name: 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-3-piperidinecarboxylic acid hydrochloride IUPAC Name: 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine-3-carboxylic acid hydrochloride Traditional Name: 1-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]nipecotic acid hydrochloride Formula: C21H25Cl2NO3 MolecularWeight: 410.3341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)O.Cl

Isomeric SMILES

C1CC(CN(C1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)O.Cl

InChI

InChI=1S/C21H24ClNO3.ClH/c22-19-10-8-17(9-11-19)20(16-5-2-1-3-6-16)26-14-13-23-12-4-7-18(15-23)21(24)25;/h1-3,5-6,8-11,18,20H,4,7,12-15H2,(H,24,25);1H