diethyl 4-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1-methyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1-methyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-1-methyl-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C20H24N2O8 MolecularWeight: 420.41316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2C(=CN(C=C2C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C20H24N2O8/c1-5-28-16-9-12(8-15(18(16)23)22(26)27)17-13(19(24)29-6-2)10-21(4)11-14(17)20(25)30-7-3/h8-11,17,23H,5-7H2,1-4H3