5-(heptan-2-ylsulfamoyl)-2-methyl-benzoic acid

Systemtic Name: 5-(heptan-2-ylsulfamoyl)-2-methyl-benzoic acid Openeye Name: 2-methyl-5-(1-methylhexylsulfamoyl)benzoic acid CAS Name: 5-(heptan-2-ylsulfamoyl)-2-methylbenzoic acid IUPAC Name: 5-(heptan-2-ylsulfamoyl)-2-methylbenzoic acid Traditional Name: 2-methyl-5-(1-methylhexylsulfamoyl)benzoic acid Formula: C15H23NO4S MolecularWeight: 313.41242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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