diethyl 2-(2-chloranyl-6-methyl-5-nitro-pyrimidin-4-yl)propanedioate

Systemtic Name: diethyl 2-(2-chloranyl-6-methyl-5-nitro-pyrimidin-4-yl)propanedioate Openeye Name: diethyl 2-(2-chloro-6-methyl-5-nitro-pyrimidin-4-yl)propanedioate CAS Name: 2-(2-chloro-6-methyl-5-nitro-4-pyrimidinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-chloro-6-methyl-5-nitropyrimidin-4-yl)propanedioate Traditional Name: 2-(2-chloro-6-methyl-5-nitro-pyrimidin-4-yl)malonic acid diethyl ester Formula: C12H14ClN3O6 MolecularWeight: 331.70906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3O6/c1-4-21-10(17)7(11(18)22-5-2)8-9(16(19)20)6(3)14-12(13)15-8/h7H,4-5H2,1-3H3