3,4-dimethyl-5-[methyl(2-methylpropyl)sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[methyl(2-methylpropyl)sulfamoyl]benzoic acid Openeye Name: 3-[isobutyl(methyl)sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3,4-dimethyl-5-[methyl(2-methylpropyl)sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[methyl(2-methylpropyl)sulfamoyl]benzoic acid Traditional Name: 3-[isobutyl(methyl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C14H21NO4S MolecularWeight: 299.38584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N(C)CC(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N(C)CC(C)C)C

InChI

InChI=1S/C14H21NO4S/c1-9(2)8-15(5)20(18,19)13-7-12(14(16)17)6-10(3)11(13)4/h6-7,9H,8H2,1-5H3,(H,16,17)