ethyl 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoate

Systemtic Name: ethyl 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoate Openeye Name: ethyl 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoate CAS Name: 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoate Traditional Name: 4-(ethylamino)-3-[(4-sulfamoylphenyl)sulfonylamino]benzoic acid ethyl ester Formula: C17H21N3O6S2 MolecularWeight: 427.49514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O6S2/c1-3-19-15-10-5-12(17(21)26-4-2)11-16(15)20-28(24,25)14-8-6-13(7-9-14)27(18,22)23/h5-11,19-20H,3-4H2,1-2H3,(H2,18,22,23)