diethyl 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl]-2-nitro-propanedioate

Systemtic Name: diethyl 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl]-2-nitro-propanedioate Openeye Name: diethyl 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methyl]-2-nitro-propanedioate CAS Name: 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methyl]-2-nitropropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methyl]-2-nitropropanedioate Traditional Name: 2-[(2,4-diketo-1H-pyrimidin-5-yl)methyl]-2-nitro-malonic acid diethyl ester Formula: C12H15N3O8 MolecularWeight: 329.2628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC(=O)NC1=O)(C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=CNC(=O)NC1=O)(C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O8/c1-3-22-9(17)12(15(20)21,10(18)23-4-2)5-7-6-13-11(19)14-8(7)16/h6H,3-5H2,1-2H3,(H2,13,14,16,19)