4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-fluoranyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-fluoranyl-piperidine-1-carboxylic acid Openeye Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-fluoro-piperidine-1-carboxylic acid CAS Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-fluoro-1-piperidinecarboxylic acid IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-fluoropiperidine-1-carboxylic acid Traditional Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-fluoro-piperidine-1-carboxylic acid Formula: C13H12ClF4NO2 MolecularWeight: 325.686493

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)F)C(=O)O

Isomeric SMILES

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)F)C(=O)O

InChI

InChI=1S/C13H12ClF4NO2/c14-10-2-1-8(7-9(10)13(16,17)18)12(15)3-5-19(6-4-12)11(20)21/h1-2,7H,3-6H2,(H,20,21)