diethyl 4-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-[5-(4-chlorophenyl)-2-phenyl-3-pyrazolyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[5-(4-chlorophenyl)-2-phenylpyrazol-3-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C28H28ClN3O4 MolecularWeight: 505.99262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C(=O)OCC)C)C

InChI

InChI=1S/C28H28ClN3O4/c1-5-35-27(33)24-17(3)30-18(4)25(28(34)36-6-2)26(24)23-16-22(19-12-14-20(29)15-13-19)31-32(23)21-10-8-7-9-11-21/h7-16,26,30H,5-6H2,1-4H3