5-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]-2-fluoro-benzoic acid CAS Name: 5-[[3-(dimethylsulfamoyl)-4-methylphenyl]sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[[3-(dimethylsulfamoyl)-4-methylphenyl]sulfamoyl]-2-fluorobenzoic acid Traditional Name: 5-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]-2-fluoro-benzoic acid Formula: C16H17FN2O6S2 MolecularWeight: 416.444383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O)S(=O)(=O)N(C)C

InChI

InChI=1S/C16H17FN2O6S2/c1-10-4-5-11(8-15(10)27(24,25)19(2)3)18-26(22,23)12-6-7-14(17)13(9-12)16(20)21/h4-9,18H,1-3H3,(H,20,21)