2-[(phenylmethylsulfanyl)sulfamoyl]benzoic acid

Systemtic Name: 2-[(phenylmethylsulfanyl)sulfamoyl]benzoic acid Openeye Name: 2-(benzylsulfanylsulfamoyl)benzoic acid CAS Name: 2-[(phenylmethylthio)sulfamoyl]benzoic acid IUPAC Name: 2-(benzylsulfanylsulfamoyl)benzoic acid Traditional Name: 2-[(benzylthio)sulfamoyl]benzoic acid Formula: C14H13NO4S2 MolecularWeight: 323.38732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSNS(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSNS(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H13NO4S2/c16-14(17)12-8-4-5-9-13(12)21(18,19)15-20-10-11-6-2-1-3-7-11/h1-9,15H,10H2,(H,16,17)