3-[(4-methylsulfanylphenyl)sulfamoyl]benzoate

Systemtic Name: 3-[(4-methylsulfanylphenyl)sulfamoyl]benzoate Openeye Name: 3-[(4-methylsulfanylphenyl)sulfamoyl]benzoate CAS Name: 3-[[4-(methylthio)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[(4-methylsulfanylphenyl)sulfamoyl]benzoate Traditional Name: 3-[[4-(methylthio)phenyl]sulfamoyl]benzoate Formula: C14H12NO4S2- MolecularWeight: 322.37938

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-]

InChI

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