diethyl 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylate

Systemtic Name: diethyl 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylate Openeye Name: diethyl 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylate CAS Name: 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylate Traditional Name: 5-phenyl-1-(4-sulfamoylphenyl)pyrazole-3,4-dicarboxylic acid diethyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C(=O)OCC)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C(=O)OCC)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O6S/c1-3-29-20(25)17-18(21(26)30-4-2)23-24(19(17)14-8-6-5-7-9-14)15-10-12-16(13-11-15)31(22,27)28/h5-13H,3-4H2,1-2H3,(H2,22,27,28)