4-cyano-4-[2-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid

Systemtic Name: 4-cyano-4-[2-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid Openeye Name: 4-cyano-4-[2-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid CAS Name: 4-cyano-4-[2-(trifluoromethyl)phenyl]-1-piperidinecarboxylic acid IUPAC Name: 4-cyano-4-[2-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid Traditional Name: 4-cyano-4-[2-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid Formula: C14H13F3N2O2 MolecularWeight: 298.26043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H13F3N2O2/c15-14(16,17)11-4-2-1-3-10(11)13(9-18)5-7-19(8-6-13)12(20)21/h1-4H,5-8H2,(H,20,21)