4-[3,3,3-tris(fluoranyl)propylsulfanyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-[3,3,3-tris(fluoranyl)propylsulfanyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-(3,3,3-trifluoropropylsulfanyl)pyrrolidine-2-carboxylic acid CAS Name: 4-(3,3,3-trifluoropropylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3,3,3-trifluoropropylsulfanyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(3,3,3-trifluoropropylthio)proline Formula: C8H12F3NO2S MolecularWeight: 243.24659

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)O)SCCC(F)(F)F

Isomeric SMILES

C1C(CNC1C(=O)O)SCCC(F)(F)F

InChI

InChI=1S/C8H12F3NO2S/c9-8(10,11)1-2-15-5-3-6(7(13)14)12-4-5/h5-6,12H,1-4H2,(H,13,14)