dimethyl 2-[[2-(propylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[2-(propylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(propylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(propylamino)-5-sulfamoylphenyl]sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(propylamino)-5-sulfamoylphenyl]sulfamoyl]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(propylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C19H23N3O8S2 MolecularWeight: 485.53122

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H23N3O8S2/c1-4-9-21-15-8-6-13(31(20,25)26)11-16(15)22-32(27,28)17-10-12(18(23)29-2)5-7-14(17)19(24)30-3/h5-8,10-11,21-22H,4,9H2,1-3H3,(H2,20,25,26)