diethyl 2-(2-methyl-1-nitro-3-oxidanylidene-butan-2-yl)propanedioate

Systemtic Name: diethyl 2-(2-methyl-1-nitro-3-oxidanylidene-butan-2-yl)propanedioate Openeye Name: diethyl 2-[1-methyl-1-(nitromethyl)-2-oxo-propyl]propanedioate CAS Name: 2-(2-methyl-1-nitro-3-oxobutan-2-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-methyl-1-nitro-3-oxobutan-2-yl)propanedioate Traditional Name: 2-[2-keto-1-methyl-1-(nitromethyl)propyl]malonic acid diethyl ester Formula: C12H19NO7 MolecularWeight: 289.28176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO7/c1-5-19-10(15)9(11(16)20-6-2)12(4,8(3)14)7-13(17)18/h9H,5-7H2,1-4H3