diethyl 2-[4-nitro-3-(phenylcarbonyl)phenyl]propanedioate

Systemtic Name: diethyl 2-[4-nitro-3-(phenylcarbonyl)phenyl]propanedioate Openeye Name: diethyl 2-(3-benzoyl-4-nitro-phenyl)propanedioate CAS Name: 2-(3-benzoyl-4-nitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-benzoyl-4-nitrophenyl)propanedioate Traditional Name: 2-(3-benzoyl-4-nitro-phenyl)malonic acid diethyl ester Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO7/c1-3-27-19(23)17(20(24)28-4-2)14-10-11-16(21(25)26)15(12-14)18(22)13-8-6-5-7-9-13/h5-12,17H,3-4H2,1-2H3