2-sulfamoyl-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzoic acid

Systemtic Name: 2-sulfamoyl-4-[2,2,2-tris(fluoranyl)ethylsulfanyl]benzoic acid Openeye Name: 2-sulfamoyl-4-(2,2,2-trifluoroethylsulfanyl)benzoic acid CAS Name: 2-sulfamoyl-4-(2,2,2-trifluoroethylthio)benzoic acid IUPAC Name: 2-sulfamoyl-4-(2,2,2-trifluoroethylsulfanyl)benzoic acid Traditional Name: 2-sulfamoyl-4-(2,2,2-trifluoroethylthio)benzoic acid Formula: C9H8F3NO4S2 MolecularWeight: 315.28933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCC(F)(F)F)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1SCC(F)(F)F)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C9H8F3NO4S2/c10-9(11,12)4-18-5-1-2-6(8(14)15)7(3-5)19(13,16)17/h1-3H,4H2,(H,14,15)(H2,13,16,17)