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

Systemtic Name: diethyl 2-[(1R)-1-(2-nitrophenyl)-3-oxidanylidene-propyl]propanedioate Openeye Name: diethyl 2-[(1R)-1-(2-nitrophenyl)-3-oxo-propyl]propanedioate CAS Name: 2-[(1R)-1-(2-nitrophenyl)-3-oxopropyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(1R)-1-(2-nitrophenyl)-3-oxopropyl]propanedioate Traditional Name: 2-[(1R)-3-keto-1-(2-nitrophenyl)propyl]malonic acid diethyl ester Formula: C16H19NO7 MolecularWeight: 337.32456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO7/c1-3-23-15(19)14(16(20)24-4-2)12(9-10-18)11-7-5-6-8-13(11)17(21)22/h5-8,10,12,14H,3-4,9H2,1-2H3/t12-/m0/s1