4-methyl-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-methyl-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-methyl-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid CAS Name: 2-hydroxy-4-methyl-5-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-4-methyl-5-[(4-methyl-3-sulfamoylphenyl)sulfamoyl]benzoic acid Traditional Name: 2-hydroxy-4-methyl-5-[(4-methyl-3-sulfamoyl-phenyl)sulfamoyl]benzoic acid Formula: C15H16N2O7S2 MolecularWeight: 400.42674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O7S2/c1-8-3-4-10(6-13(8)25(16,21)22)17-26(23,24)14-7-11(15(19)20)12(18)5-9(14)2/h3-7,17-18H,1-2H3,(H,19,20)(H2,16,21,22)