3-fluoranyl-4-methyl-5-(2-methylbutan-2-ylsulfamoyl)benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-(2-methylbutan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-(1,1-dimethylpropylsulfamoyl)-5-fluoro-4-methyl-benzoic acid CAS Name: 3-fluoro-4-methyl-5-(2-methylbutan-2-ylsulfamoyl)benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-(2-methylbutan-2-ylsulfamoyl)benzoic acid Traditional Name: 3-(tert-amylsulfamoyl)-5-fluoro-4-methyl-benzoic acid Formula: C13H18FNO4S MolecularWeight: 303.349723

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

Isomeric SMILES

CCC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1C)F)C(=O)O

InChI

InChI=1S/C13H18FNO4S/c1-5-13(3,4)15-20(18,19)11-7-9(12(16)17)6-10(14)8(11)2/h6-7,15H,5H2,1-4H3,(H,16,17)