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

Systemtic Name: 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-2-carboxylic acid Openeye Name: 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-2-carboxylic acid CAS Name: 1-[3-(trifluoromethyl)phenyl]sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-[3-(trifluoromethyl)phenyl]sulfonylpipecolinic acid Formula: C13H14F3NO4S MolecularWeight: 337.31477

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1CCN(C(C1)C(=O)O)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C13H14F3NO4S/c14-13(15,16)9-4-3-5-10(8-9)22(20,21)17-7-2-1-6-11(17)12(18)19/h3-5,8,11H,1-2,6-7H2,(H,18,19)