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

Systemtic Name: 1-[(4-chlorophenyl)methyl]piperidine-3-carboxylic acid hydrochloride Openeye Name: 1-[(4-chlorophenyl)methyl]piperidine-3-carboxylic acid hydrochloride CAS Name: 1-[(4-chlorophenyl)methyl]-3-piperidinecarboxylic acid hydrochloride IUPAC Name: 1-[(4-chlorophenyl)methyl]piperidine-3-carboxylic acid hydrochloride Traditional Name: 1-(4-chlorobenzyl)nipecotic acid hydrochloride Formula: C13H17Cl2NO2 MolecularWeight: 290.18558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)Cl)C(=O)O.Cl

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)Cl)C(=O)O.Cl

InChI

InChI=1S/C13H16ClNO2.ClH/c14-12-5-3-10(4-6-12)8-15-7-1-2-11(9-15)13(16)17;/h3-6,11H,1-2,7-9H2,(H,16,17);1H