1-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(2-chloro-6-fluoro-benzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(2-chloro-6-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-chloro-6-fluorobenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-chloro-6-fluoro-benzoyl)isonipecotic acid Formula: C13H13ClFNO3 MolecularWeight: 285.698623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H13ClFNO3/c14-9-2-1-3-10(15)11(9)12(17)16-6-4-8(5-7-16)13(18)19/h1-3,8H,4-7H2,(H,18,19)