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

Systemtic Name: 3-[[3-(diethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[3-(diethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[3-(diethylsulfamoyl)-4-methylphenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[3-(diethylsulfamoyl)-4-methylphenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[3-(diethylsulfamoyl)-4-methyl-phenyl]sulfamoyl]benzoic acid Formula: C18H22N2O6S2 MolecularWeight: 426.50708

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O)C

InChI

InChI=1S/C18H22N2O6S2/c1-4-20(5-2)28(25,26)17-12-15(10-9-13(17)3)19-27(23,24)16-8-6-7-14(11-16)18(21)22/h6-12,19H,4-5H2,1-3H3,(H,21,22)