O4-(cyanomethyl) O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O4-(cyanomethyl) O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O4-(cyanomethyl) O3,O5-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-(cyanomethyl) ester O3,O5-dimethyl ester IUPAC Name: 4-O-(cyanomethyl) 3-O,5-O-dimethyl (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O4-(cyanomethyl) ester O3,O5-dimethyl ester Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C(=O)OCC#N)C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OC)C(=O)OCC#N)C(=O)OC)C

InChI

InChI=1S/C14H16N2O6/c1-7-9(12(17)20-3)11(14(19)22-6-5-15)10(8(2)16-7)13(18)21-4/h9,11H,6H2,1-4H3/t9?,11-/m0/s1