4-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 4-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid CAS Name: 4-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]benzoic acid IUPAC Name: 4-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid Formula: C14H14N2O6S2 MolecularWeight: 370.40076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O6S2/c1-9-2-5-11(8-13(9)23(15,19)20)16-24(21,22)12-6-3-10(4-7-12)14(17)18/h2-8,16H,1H3,(H,17,18)(H2,15,19,20)