ethyl 4-[[2-(butylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[2-(butylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[2-(butylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzoate CAS Name: 4-[[2-(butylamino)-5-sulfamoylphenyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(butylamino)-5-sulfamoylphenyl]sulfamoyl]benzoate Traditional Name: 4-[[2-(butylamino)-5-sulfamoyl-phenyl]sulfamoyl]benzoic acid ethyl ester Formula: C19H25N3O6S2 MolecularWeight: 455.5483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C19H25N3O6S2/c1-3-5-12-21-17-11-10-16(29(20,24)25)13-18(17)22-30(26,27)15-8-6-14(7-9-15)19(23)28-4-2/h6-11,13,21-22H,3-5,12H2,1-2H3,(H2,20,24,25)