2-(4-methylphenyl)sulfanyl-5-sulfamoyl-benzoic acid

Systemtic Name: 2-(4-methylphenyl)sulfanyl-5-sulfamoyl-benzoic acid Openeye Name: 2-(p-tolylsulfanyl)-5-sulfamoyl-benzoic acid CAS Name: 2-[(4-methylphenyl)thio]-5-sulfamoylbenzoic acid IUPAC Name: 2-(4-methylphenyl)sulfanyl-5-sulfamoylbenzoic acid Traditional Name: 2-(p-tolylthio)-5-sulfamoyl-benzoic acid Formula: C14H13NO4S2 MolecularWeight: 323.38732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C14H13NO4S2/c1-9-2-4-10(5-3-9)20-13-7-6-11(21(15,18)19)8-12(13)14(16)17/h2-8H,1H3,(H,16,17)(H2,15,18,19)