4-(butylsulfonylamino)-3-methyl-benzoic acid

Systemtic Name: 4-(butylsulfonylamino)-3-methyl-benzoic acid Openeye Name: 4-(butylsulfonylamino)-3-methyl-benzoic acid CAS Name: 4-(butylsulfonylamino)-3-methylbenzoic acid IUPAC Name: 4-(butylsulfonylamino)-3-methylbenzoic acid Traditional Name: 4-(butylsulfonylamino)-3-methyl-benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)C

Isomeric SMILES

CCCCS(=O)(=O)NC1=C(C=C(C=C1)C(=O)O)C

InChI

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