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

Systemtic Name: diethyl 1-(3-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3,4-dicarboxylate Openeye Name: diethyl 1-(3-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3,4-dicarboxylate CAS Name: 1-(3-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(3-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3,4-dicarboxylate Traditional Name: 1-(3-chlorophenyl)-5-(4-chlorophenyl)pyrazole-3,4-dicarboxylic acid diethyl ester Formula: C21H18Cl2N2O4 MolecularWeight: 433.28462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18Cl2N2O4/c1-3-28-20(26)17-18(21(27)29-4-2)24-25(16-7-5-6-15(23)12-16)19(17)13-8-10-14(22)11-9-13/h5-12H,3-4H2,1-2H3