diethyl 4-(2-chloranyl-5-nitro-phenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(2-chloranyl-5-nitro-phenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(2-chloro-5-nitro-phenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chloro-5-nitrophenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(2-chloro-5-nitrophenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chloro-5-nitro-phenyl)-2-cyano-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C19H18ClN3O6 MolecularWeight: 419.81572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OCC)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(=O)OCC)C#N)C

InChI

InChI=1S/C19H18ClN3O6/c1-4-28-18(24)15-10(3)22-14(9-21)17(19(25)29-5-2)16(15)12-8-11(23(26)27)6-7-13(12)20/h6-8,16,22H,4-5H2,1-3H3