diethyl 4-(3,5-dinitro-2-oxidanyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(3,5-dinitro-2-oxidanyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(2-hydroxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-hydroxy-3,5-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(2-hydroxy-3,5-dinitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-hydroxy-3,5-dinitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C19H21N3O9 MolecularWeight: 435.38474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-])C(=O)OCC)C)C

InChI

InChI=1S/C19H21N3O9/c1-5-30-18(24)14-9(3)20-10(4)15(19(25)31-6-2)16(14)12-7-11(21(26)27)8-13(17(12)23)22(28)29/h7-8,16,20,23H,5-6H2,1-4H3