3-(5-nitropyrimidin-2-yl)pentane-2,4-dione

Systemtic Name: 3-(5-nitropyrimidin-2-yl)pentane-2,4-dione Openeye Name: 3-(5-nitropyrimidin-2-yl)pentane-2,4-dione CAS Name: 3-(5-nitro-2-pyrimidinyl)pentane-2,4-dione IUPAC Name: 3-(5-nitropyrimidin-2-yl)pentane-2,4-dione Traditional Name: 3-(5-nitropyrimidin-2-yl)pentane-2,4-dione Formula: C9H9N3O4 MolecularWeight: 223.18546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=NC=C(C=N1)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC(=O)C(C1=NC=C(C=N1)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C9H9N3O4/c1-5(13)8(6(2)14)9-10-3-7(4-11-9)12(15)16/h3-4,8H,1-2H3