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

Systemtic Name: 2,4-dimethyl-5-[methyl(pentan-3-yl)sulfamoyl]benzoic acid Openeye Name: 5-[1-ethylpropyl(methyl)sulfamoyl]-2,4-dimethyl-benzoic acid CAS Name: 2,4-dimethyl-5-[methyl(pentan-3-yl)sulfamoyl]benzoic acid IUPAC Name: 2,4-dimethyl-5-[methyl(pentan-3-yl)sulfamoyl]benzoic acid Traditional Name: 5-[1-ethylpropyl(methyl)sulfamoyl]-2,4-dimethyl-benzoic acid Formula: C15H23NO4S MolecularWeight: 313.41242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO4S/c1-6-12(7-2)16(5)21(19,20)14-9-13(15(17)18)10(3)8-11(14)4/h8-9,12H,6-7H2,1-5H3,(H,17,18)