1-[2-(trifluoromethylsulfanyl)phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(trifluoromethylsulfanyl)phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(trifluoromethylsulfanyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[oxo-[2-(trifluoromethylthio)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(trifluoromethylsulfanyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(trifluoromethylthio)benzoyl]proline Formula: C13H12F3NO3S MolecularWeight: 319.29949

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CC=C2SC(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CC=C2SC(F)(F)F)C(=O)O

InChI

InChI=1S/C13H12F3NO3S/c14-13(15,16)21-10-6-2-1-4-8(10)11(18)17-7-3-5-9(17)12(19)20/h1-2,4,6,9H,3,5,7H2,(H,19,20)