dipropan-2-yl 2-[(1R)-1-(4-nitrophenyl)-3-oxidanylidene-butyl]propanedioate

Systemtic Name: dipropan-2-yl 2-[(1R)-1-(4-nitrophenyl)-3-oxidanylidene-butyl]propanedioate Openeye Name: diisopropyl 2-[(1R)-1-(4-nitrophenyl)-3-oxo-butyl]propanedioate CAS Name: 2-[(1R)-1-(4-nitrophenyl)-3-oxobutyl]propanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 2-[(1R)-1-(4-nitrophenyl)-3-oxobutyl]propanedioate Traditional Name: 2-[(1R)-3-keto-1-(4-nitrophenyl)butyl]malonic acid diisopropyl ester Formula: C19H25NO7 MolecularWeight: 379.4043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO7/c1-11(2)26-18(22)17(19(23)27-12(3)4)16(10-13(5)21)14-6-8-15(9-7-14)20(24)25/h6-9,11-12,16-17H,10H2,1-5H3/t16-/m0/s1