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

Systemtic Name: diethyl 2-(2-methyl-1-nitro-3-oxidanylidene-pentan-2-yl)propanedioate Openeye Name: diethyl 2-[1-methyl-1-(nitromethyl)-2-oxo-butyl]propanedioate CAS Name: 2-(2-methyl-1-nitro-3-oxopentan-2-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-methyl-1-nitro-3-oxopentan-2-yl)propanedioate Traditional Name: 2-[2-keto-1-methyl-1-(nitromethyl)butyl]malonic acid diethyl ester Formula: C13H21NO7 MolecularWeight: 303.30834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO7/c1-5-9(15)13(4,8-14(18)19)10(11(16)20-6-2)12(17)21-7-3/h10H,5-8H2,1-4H3