1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidine-3-carboxylic acid hydrochloride

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidine-3-carboxylic acid hydrochloride Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]piperidine-3-carboxylic acid hydrochloride CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-piperidinecarboxylic acid hydrochloride IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]piperidine-3-carboxylic acid hydrochloride Traditional Name: 1-(2-chloro-6-fluoro-benzyl)nipecotic acid hydrochloride Formula: C13H16Cl2FNO2 MolecularWeight: 308.176043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C=CC=C2Cl)F)C(=O)O.Cl

Isomeric SMILES

C1CC(CN(C1)CC2=C(C=CC=C2Cl)F)C(=O)O.Cl

InChI

InChI=1S/C13H15ClFNO2.ClH/c14-11-4-1-5-12(15)10(11)8-16-6-2-3-9(7-16)13(17)18;/h1,4-5,9H,2-3,6-8H2,(H,17,18);1H