2-ethylsulfanyl-5-sulfamoyl-benzoic acid

Systemtic Name: 2-ethylsulfanyl-5-sulfamoyl-benzoic acid Openeye Name: 2-ethylsulfanyl-5-sulfamoyl-benzoic acid CAS Name: 2-(ethylthio)-5-sulfamoylbenzoic acid IUPAC Name: 2-ethylsulfanyl-5-sulfamoylbenzoic acid Traditional Name: 2-(ethylthio)-5-sulfamoyl-benzoic acid Formula: C9H11NO4S2 MolecularWeight: 261.31794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CCSC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C9H11NO4S2/c1-2-15-8-4-3-6(16(10,13)14)5-7(8)9(11)12/h3-5H,2H2,1H3,(H,11,12)(H2,10,13,14)