4-bromanyl-3-[2,2,2-tris(fluoranyl)ethylsulfamoyl]benzoic acid

Systemtic Name: 4-bromanyl-3-[2,2,2-tris(fluoranyl)ethylsulfamoyl]benzoic acid Openeye Name: 4-bromo-3-(2,2,2-trifluoroethylsulfamoyl)benzoic acid CAS Name: 4-bromo-3-(2,2,2-trifluoroethylsulfamoyl)benzoic acid IUPAC Name: 4-bromo-3-(2,2,2-trifluoroethylsulfamoyl)benzoic acid Traditional Name: 4-bromo-3-(2,2,2-trifluoroethylsulfamoyl)benzoic acid Formula: C9H7BrF3NO4S MolecularWeight: 362.12039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)NCC(F)(F)F)Br

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)S(=O)(=O)NCC(F)(F)F)Br

InChI

InChI=1S/C9H7BrF3NO4S/c10-6-2-1-5(8(15)16)3-7(6)19(17,18)14-4-9(11,12)13/h1-3,14H,4H2,(H,15,16)