O5-ethyl O3-methyl 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2,6-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C18H19N3O8 MolecularWeight: 405.35876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O8/c1-5-29-18(23)14-10(3)19-9(2)13(17(22)28-4)16(14)15-11(20(24)25)7-6-8-12(15)21(26)27/h6-8,16,19H,5H2,1-4H3