4-butyl-2-(methylsulfonylamino)benzoic acid

Systemtic Name: 4-butyl-2-(methylsulfonylamino)benzoic acid Openeye Name: 4-butyl-2-(methanesulfonamido)benzoic acid CAS Name: 4-butyl-2-(methanesulfonamido)benzoic acid IUPAC Name: 4-butyl-2-(methanesulfonamido)benzoic acid Traditional Name: 4-butyl-2-(methanesulfonamido)benzoic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C(=O)O)NS(=O)(=O)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C12H17NO4S/c1-3-4-5-9-6-7-10(12(14)15)11(8-9)13-18(2,16)17/h6-8,13H,3-5H2,1-2H3,(H,14,15)