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

Systemtic Name: 4-methyl-3-(2-methylbutan-2-ylsulfamoyl)benzoic acid Openeye Name: 3-(1,1-dimethylpropylsulfamoyl)-4-methyl-benzoic acid CAS Name: 4-methyl-3-(2-methylbutan-2-ylsulfamoyl)benzoic acid IUPAC Name: 4-methyl-3-(2-methylbutan-2-ylsulfamoyl)benzoic acid Traditional Name: 3-(tert-amylsulfamoyl)-4-methyl-benzoic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO4S/c1-5-13(3,4)14-19(17,18)11-8-10(12(15)16)7-6-9(11)2/h6-8,14H,5H2,1-4H3,(H,15,16)