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

Systemtic Name: diethyl 2,6-dimethyl-4-(3-nitro-4-oxidanyl-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(4-hydroxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(4-hydroxy-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(4-hydroxy-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(4-hydroxy-3-nitro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C19H22N2O7 MolecularWeight: 390.38718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O7/c1-5-27-18(23)15-10(3)20-11(4)16(19(24)28-6-2)17(15)12-7-8-14(22)13(9-12)21(25)26/h7-9,17,20,22H,5-6H2,1-4H3