1-[2-(trifluoromethyl)phenyl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[2-(trifluoromethyl)phenyl]carbonylpiperidine-3-carboxylic acid Openeye Name: 1-[2-(trifluoromethyl)benzoyl]piperidine-3-carboxylic acid CAS Name: 1-[oxo-[2-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(trifluoromethyl)benzoyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(trifluoromethyl)benzoyl]nipecotic acid Formula: C14H14F3NO3 MolecularWeight: 301.26107

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H14F3NO3/c15-14(16,17)11-6-2-1-5-10(11)12(19)18-7-3-4-9(8-18)13(20)21/h1-2,5-6,9H,3-4,7-8H2,(H,20,21)