O3-methyl O5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-methyl 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-propan-2-yl ester IUPAC Name: 3-O-methyl 5-O-propan-2-yl 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-cyano-6-methyl-4-(3-nitrocyclohexyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-methyl ester Formula: C19H25N3O6 MolecularWeight: 391.4183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C#N)C(=O)OC)C2CCCC(C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1)C#N)C(=O)OC)C2CCCC(C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C19H25N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h10,12-13,16,21H,5-8H2,1-4H3