5-[butan-2-yl(methyl)sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[butan-2-yl(methyl)sulfamoyl]-2-methyl-benzoic acid Openeye Name: 2-methyl-5-[methyl(sec-butyl)sulfamoyl]benzoic acid CAS Name: 5-[butan-2-yl(methyl)sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[butan-2-yl(methyl)sulfamoyl]-2-methylbenzoic acid Traditional Name: 2-methyl-5-[methyl(sec-butyl)sulfamoyl]benzoic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)O

Isomeric SMILES

CCC(C)N(C)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)O

InChI

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