(5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)methyl ethanoate

Systemtic Name: (5-nitro-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)methyl ethanoate Openeye Name: (4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)methyl acetate CAS Name: acetic acid (4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)methyl ester IUPAC Name: (4-hydroxy-5-nitro-6-oxo-1H-pyrimidin-2-yl)methyl acetate Traditional Name: acetic acid (4-hydroxy-6-keto-5-nitro-1H-pyrimidin-2-yl)methyl ester Formula: C7H7N3O6 MolecularWeight: 229.14698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=NC(=C(C(=O)N1)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)OCC1=NC(=C(C(=O)N1)[N+](=O)[O-])O

InChI

InChI=1S/C7H7N3O6/c1-3(11)16-2-4-8-6(12)5(10(14)15)7(13)9-4/h2H2,1H3,(H2,8,9,12,13)