diethyl 2-cyano-4-(2-methoxycarbonylphenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-cyano-4-(2-methoxycarbonylphenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-cyano-4-(2-methoxycarbonylphenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyano-4-(2-methoxycarbonylphenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-cyano-4-(2-methoxycarbonylphenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-carbomethoxyphenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(=O)OC)C(=O)OCC)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(=O)OC)C(=O)OCC)C#N)C

InChI

InChI=1S/C21H22N2O6/c1-5-28-20(25)16-12(3)23-15(11-22)18(21(26)29-6-2)17(16)13-9-7-8-10-14(13)19(24)27-4/h7-10,17,23H,5-6H2,1-4H3