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

Systemtic Name: O5-methyl O3-propan-2-yl 2-(acetyloxymethyl)-6-cyano-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-isopropyl O5-methyl 2-(acetoxymethyl)-6-cyano-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(acetyloxymethyl)-6-cyano-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-methyl ester O3-propan-2-yl ester IUPAC Name: 5-O-methyl 3-O-propan-2-yl 2-(acetyloxymethyl)-6-cyano-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(acetoxymethyl)-6-cyano-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-isopropyl ester O5-methyl ester Formula: C21H21N3O8 MolecularWeight: 443.40674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C#N)COC(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C#N)COC(=O)C

InChI

InChI=1S/C21H21N3O8/c1-11(2)32-21(27)19-16(10-31-12(3)25)23-15(9-22)18(20(26)30-4)17(19)13-6-5-7-14(8-13)24(28)29/h5-8,11,17,23H,10H2,1-4H3