O3-butyl O5-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate

Systemtic Name: O3-butyl O5-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Openeye Name: O3-butyl O5-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate CAS Name: 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-butyl ester O5-methyl ester IUPAC Name: 3-O-butyl 5-O-methyl 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate Traditional Name: 2-cyano-6-methyl-3-(4-nitrophenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid O3-butyl ester O5-methyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1(CC(=C(NC1C#N)C)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1(CC(=C(NC1C#N)C)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6/c1-4-5-10-29-19(25)20(14-6-8-15(9-7-14)23(26)27)11-16(18(24)28-3)13(2)22-17(20)12-21/h6-9,17,22H,4-5,10-11H2,1-3H3