3-[(3-methylsulfanylphenyl)sulfamoyl]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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