1-[(4-chloranyl-2-fluoranyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-chloranyl-2-fluoranyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-chloro-2-fluoro-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-chloro-2-fluorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-chloro-2-fluorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-chloro-2-fluoro-benzyl)isonipecotic acid Formula: C13H15ClFNO2 MolecularWeight: 271.715103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=C(C=C(C=C2)Cl)F

InChI

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