diethyl 2-(4-chlorophenyl)-5-pyridin-2-yl-3,4-dihydropyrazole-3,4-dicarboxylate

Systemtic Name: diethyl 2-(4-chlorophenyl)-5-pyridin-2-yl-3,4-dihydropyrazole-3,4-dicarboxylate Openeye Name: diethyl 2-(4-chlorophenyl)-5-(2-pyridyl)-3,4-dihydropyrazole-3,4-dicarboxylate CAS Name: 2-(4-chlorophenyl)-5-(2-pyridinyl)-3,4-dihydropyrazole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(4-chlorophenyl)-5-pyridin-2-yl-3,4-dihydropyrazole-3,4-dicarboxylate Traditional Name: 2-(4-chlorophenyl)-5-(2-pyridyl)-2-pyrazoline-3,4-dicarboxylic acid diethyl ester Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N(N=C1C2=CC=CC=N2)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C(N(N=C1C2=CC=CC=N2)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C20H20ClN3O4/c1-3-27-19(25)16-17(15-7-5-6-12-22-15)23-24(18(16)20(26)28-4-2)14-10-8-13(21)9-11-14/h5-12,16,18H,3-4H2,1-2H3