bis(2-cyanoethyl) (4R)-2,6-dimethyl-4-pyridin-3-yl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(2-cyanoethyl) (4R)-2,6-dimethyl-4-pyridin-3-yl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis(2-cyanoethyl) (4R)-2,6-dimethyl-4-(3-pyridyl)-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4R)-2,6-dimethyl-4-(3-pyridinyl)-3,4-dihydropyridine-3,5-dicarboxylic acid bis(2-cyanoethyl) ester IUPAC Name: bis(2-cyanoethyl) (4R)-2,6-dimethyl-4-pyridin-3-yl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4R)-2,6-dimethyl-4-(3-pyridyl)-3,4-dihydropyridine-3,5-dicarboxylic acid bis(2-cyanoethyl) ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCCC#N)C2=CN=CC=C2)C(=O)OCCC#N)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OCCC#N)C2=CN=CC=C2)C(=O)OCCC#N)C

InChI

InChI=1S/C20H20N4O4/c1-13-16(19(25)27-10-4-7-21)18(15-6-3-9-23-12-15)17(14(2)24-13)20(26)28-11-5-8-22/h3,6,9,12,16,18H,4-5,10-11H2,1-2H3/t16?,18-/m0/s1