5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid

Systemtic Name: 5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid Openeye Name: 5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid CAS Name: 5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methylbenzoic acid IUPAC Name: 5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methylbenzoic acid Traditional Name: 5-[[5-(dimethylsulfamoyl)-2-(ethylamino)phenyl]sulfamoyl]-2-methyl-benzoic acid Formula: C18H23N3O6S2 MolecularWeight: 441.52172

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O

Isomeric SMILES

CCNC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)O

InChI

InChI=1S/C18H23N3O6S2/c1-5-19-16-9-8-14(29(26,27)21(3)4)11-17(16)20-28(24,25)13-7-6-12(2)15(10-13)18(22)23/h6-11,19-20H,5H2,1-4H3,(H,22,23)