O5-methyl O3-(2-methylpropyl) 4-(2-cyanophenyl)-2-methanoyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-methyl O3-(2-methylpropyl) 4-(2-cyanophenyl)-2-methanoyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-isobutyl O5-methyl 4-(2-cyanophenyl)-2-formyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-cyanophenyl)-2-formyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-methyl ester O3-(2-methylpropyl) ester IUPAC Name: 5-O-methyl 3-O-(2-methylpropyl) 4-(2-cyanophenyl)-2-formyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-cyanophenyl)-2-formyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-isobutyl ester O5-methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C=O)C(=O)OCC(C)C)C2=CC=CC=C2C#N)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C=O)C(=O)OCC(C)C)C2=CC=CC=C2C#N)C(=O)OC

InChI

InChI=1S/C21H22N2O5/c1-12(2)11-28-21(26)19-16(10-24)23-13(3)17(20(25)27-4)18(19)15-8-6-5-7-14(15)9-22/h5-8,10,12,18,23H,11H2,1-4H3