5-[1,1-bis(fluoranyl)ethyl]-2-(3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)-4-methyl-pyridazin-3-one

Systemtic Name: 5-[1,1-bis(fluoranyl)ethyl]-2-(3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)-4-methyl-pyridazin-3-one Openeye Name: 5-(1,1-difluoroethyl)-2-(3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)-4-methyl-pyridazin-3-one CAS Name: 5-(1,1-difluoroethyl)-2-(3,5-dimethyl-1-oxido-2-pyridin-1-iumyl)-4-methyl-3-pyridazinone IUPAC Name: 5-(1,1-difluoroethyl)-2-(3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)-4-methylpyridazin-3-one Traditional Name: 5-(1,1-difluoroethyl)-2-(3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)-4-methyl-pyridazin-3-one Formula: C14H15F2N3O2 MolecularWeight: 295.284606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C([N+](=C1)[O-])N2C(=O)C(=C(C=N2)C(C)(F)F)C)C

Isomeric SMILES

CC1=CC(=C([N+](=C1)[O-])N2C(=O)C(=C(C=N2)C(C)(F)F)C)C

InChI

InChI=1S/C14H15F2N3O2/c1-8-5-9(2)12(18(21)7-8)19-13(20)10(3)11(6-17-19)14(4,15)16/h5-7H,1-4H3