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

Systemtic Name: 4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-cyano-piperidine-1-carboxylic acid Openeye Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-cyano-piperidine-1-carboxylic acid CAS Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-cyano-1-piperidinecarboxylic acid IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-cyanopiperidine-1-carboxylic acid Traditional Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-4-cyano-piperidine-1-carboxylic acid Formula: C14H12ClF3N2O2 MolecularWeight: 332.70549

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClF3N2O2/c15-11-2-1-9(7-10(11)14(16,17)18)13(8-19)3-5-20(6-4-13)12(21)22/h1-2,7H,3-6H2,(H,21,22)