1-[4-(diethylsulfamoyl)phenyl]-5-phenyl-pyrazole-3,4-dicarboxylic acid

Systemtic Name: 1-[4-(diethylsulfamoyl)phenyl]-5-phenyl-pyrazole-3,4-dicarboxylic acid Openeye Name: 1-[4-(diethylsulfamoyl)phenyl]-5-phenyl-pyrazole-3,4-dicarboxylic acid CAS Name: 1-[4-(diethylsulfamoyl)phenyl]-5-phenylpyrazole-3,4-dicarboxylic acid IUPAC Name: 1-[4-(diethylsulfamoyl)phenyl]-5-phenylpyrazole-3,4-dicarboxylic acid Traditional Name: 1-[4-(diethylsulfamoyl)phenyl]-5-phenyl-pyrazole-3,4-dicarboxylic acid Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C(=O)O)C(=O)O)C3=CC=CC=C3

InChI

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