1-[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(difluoromethylsulfanyl)benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[2-(difluoromethylthio)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(difluoromethylsulfanyl)benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(difluoromethylthio)benzoyl]proline Formula: C13H13F2NO3S MolecularWeight: 301.309026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F2NO3S/c14-13(15)20-10-6-2-1-4-8(10)11(17)16-7-3-5-9(16)12(18)19/h1-2,4,6,9,13H,3,5,7H2,(H,18,19)