3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid

Systemtic Name: 3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Openeye Name: 3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid CAS Name: 3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid IUPAC Name: 3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Traditional Name: 3,4-dimethyl-5-(2-sulfamoylethylsulfamoyl)benzoic acid Formula: C11H16N2O6S2 MolecularWeight: 336.38454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCS(=O)(=O)N)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCS(=O)(=O)N)C

InChI

InChI=1S/C11H16N2O6S2/c1-7-5-9(11(14)15)6-10(8(7)2)21(18,19)13-3-4-20(12,16)17/h5-6,13H,3-4H2,1-2H3,(H,14,15)(H2,12,16,17)