1,1,1-tris(chloranyl)-3-(2,6-dimethoxy-5-nitro-pyrimidin-4-yl)propan-2-one

Systemtic Name: 1,1,1-tris(chloranyl)-3-(2,6-dimethoxy-5-nitro-pyrimidin-4-yl)propan-2-one Openeye Name: 1,1,1-trichloro-3-(2,6-dimethoxy-5-nitro-pyrimidin-4-yl)propan-2-one CAS Name: 1,1,1-trichloro-3-(2,6-dimethoxy-5-nitro-4-pyrimidinyl)-2-propanone IUPAC Name: 1,1,1-trichloro-3-(2,6-dimethoxy-5-nitropyrimidin-4-yl)propan-2-one Traditional Name: 1,1,1-trichloro-3-(2,6-dimethoxy-5-nitro-pyrimidin-4-yl)acetone Formula: C9H8Cl3N3O5 MolecularWeight: 344.53592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1[N+](=O)[O-])CC(=O)C(Cl)(Cl)Cl)OC

Isomeric SMILES

COC1=NC(=NC(=C1[N+](=O)[O-])CC(=O)C(Cl)(Cl)Cl)OC

InChI

InChI=1S/C9H8Cl3N3O5/c1-19-7-6(15(17)18)4(13-8(14-7)20-2)3-5(16)9(10,11)12/h3H2,1-2H3