diethyl 2-[3-(4-nitrophenyl)-3-oxidanylidene-1-phenyl-propyl]propanedioate

Systemtic Name: diethyl 2-[3-(4-nitrophenyl)-3-oxidanylidene-1-phenyl-propyl]propanedioate Openeye Name: diethyl 2-[3-(4-nitrophenyl)-3-oxo-1-phenyl-propyl]propanedioate CAS Name: 2-[3-(4-nitrophenyl)-3-oxo-1-phenylpropyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-(4-nitrophenyl)-3-oxo-1-phenylpropyl]propanedioate Traditional Name: 2-[3-keto-3-(4-nitrophenyl)-1-phenyl-propyl]malonic acid diethyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO7/c1-3-29-21(25)20(22(26)30-4-2)18(15-8-6-5-7-9-15)14-19(24)16-10-12-17(13-11-16)23(27)28/h5-13,18,20H,3-4,14H2,1-2H3