2-(6-methoxypyridin-3-yl)-6-(oxiran-2-ylcarbonyl)-5-(trifluoromethyl)pyridazin-3-one

Systemtic Name: 2-(6-methoxypyridin-3-yl)-6-(oxiran-2-ylcarbonyl)-5-(trifluoromethyl)pyridazin-3-one Openeye Name: 2-(6-methoxy-3-pyridyl)-6-(oxirane-2-carbonyl)-5-(trifluoromethyl)pyridazin-3-one CAS Name: 2-(6-methoxy-3-pyridinyl)-6-[2-oxiranyl(oxo)methyl]-5-(trifluoromethyl)-3-pyridazinone IUPAC Name: 2-(6-methoxypyridin-3-yl)-6-(oxirane-2-carbonyl)-5-(trifluoromethyl)pyridazin-3-one Traditional Name: 2-(6-methoxy-3-pyridyl)-6-(oxirane-2-carbonyl)-5-(trifluoromethyl)pyridazin-3-one Formula: C14H10F3N3O4 MolecularWeight: 341.24211

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)N2C(=O)C=C(C(=N2)C(=O)C3CO3)C(F)(F)F

Isomeric SMILES

COC1=NC=C(C=C1)N2C(=O)C=C(C(=N2)C(=O)C3CO3)C(F)(F)F

InChI

InChI=1S/C14H10F3N3O4/c1-23-10-3-2-7(5-18-10)20-11(21)4-8(14(15,16)17)12(19-20)13(22)9-6-24-9/h2-5,9H,6H2,1H3