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

Systemtic Name: diethyl 1-(4-chlorophenyl)-5-phenyl-pyrazole-3,4-dicarboxylate Openeye Name: diethyl 1-(4-chlorophenyl)-5-phenyl-pyrazole-3,4-dicarboxylate CAS Name: 1-(4-chlorophenyl)-5-phenylpyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(4-chlorophenyl)-5-phenylpyrazole-3,4-dicarboxylate Traditional Name: 1-(4-chlorophenyl)-5-phenyl-pyrazole-3,4-dicarboxylic acid diethyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O4/c1-3-27-20(25)17-18(21(26)28-4-2)23-24(16-12-10-15(22)11-13-16)19(17)14-8-6-5-7-9-14/h5-13H,3-4H2,1-2H3