3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[[2-[(4-fluorophenyl)sulfonylamino]phenyl]sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C21H19FN2O6S2 MolecularWeight: 478.513763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H19FN2O6S2/c1-13-11-15(21(25)26)12-20(14(13)2)32(29,30)24-19-6-4-3-5-18(19)23-31(27,28)17-9-7-16(22)8-10-17/h3-12,23-24H,1-2H3,(H,25,26)