diethyl 2-(2-nitro-4-pyridin-4-yl-phenyl)carbonylpropanedioate

Systemtic Name: diethyl 2-(2-nitro-4-pyridin-4-yl-phenyl)carbonylpropanedioate Openeye Name: diethyl 2-[2-nitro-4-(4-pyridyl)benzoyl]propanedioate CAS Name: 2-[(2-nitro-4-pyridin-4-ylphenyl)-oxomethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-nitro-4-pyridin-4-ylbenzoyl)propanedioate Traditional Name: 2-[2-nitro-4-(4-pyridyl)benzoyl]malonic acid diethyl ester Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O7/c1-3-27-18(23)16(19(24)28-4-2)17(22)14-6-5-13(11-15(14)21(25)26)12-7-9-20-10-8-12/h5-11,16H,3-4H2,1-2H3