3-fluoranyl-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Openeye Name: 3-fluoro-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid CAS Name: 3-fluoro-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Traditional Name: 3-fluoro-4-methyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Formula: C10H13FN2O6S2 MolecularWeight: 340.348423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)NCCS(=O)(=O)N)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)NCCS(=O)(=O)N)C(=O)O)F

InChI

InChI=1S/C10H13FN2O6S2/c1-6-8(11)4-7(10(14)15)5-9(6)21(18,19)13-2-3-20(12,16)17/h4-5,13H,2-3H2,1H3,(H,14,15)(H2,12,16,17)