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

Systemtic Name: 3-(butan-2-ylsulfamoyl)-4-methyl-benzoic acid Openeye Name: 4-methyl-3-(sec-butylsulfamoyl)benzoic acid CAS Name: 3-(butan-2-ylsulfamoyl)-4-methylbenzoic acid IUPAC Name: 3-(butan-2-ylsulfamoyl)-4-methylbenzoic acid Traditional Name: 4-methyl-3-(sec-butylsulfamoyl)benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4S/c1-4-9(3)13-18(16,17)11-7-10(12(14)15)6-5-8(11)2/h5-7,9,13H,4H2,1-3H3,(H,14,15)