2-(3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)-5-(1-fluoroethyl)-4-methyl-pyridazin-3-one

Systemtic Name: 2-(3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)-5-(1-fluoroethyl)-4-methyl-pyridazin-3-one Openeye Name: 2-(3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)-5-(1-fluoroethyl)-4-methyl-pyridazin-3-one CAS Name: 2-(3,5-dimethyl-1-oxido-2-pyridin-1-iumyl)-5-(1-fluoroethyl)-4-methyl-3-pyridazinone IUPAC Name: 2-(3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)-5-(1-fluoroethyl)-4-methylpyridazin-3-one Traditional Name: 2-(3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)-5-(1-fluoroethyl)-4-methyl-pyridazin-3-one Formula: C14H16FN3O2 MolecularWeight: 277.294143

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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)C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H16FN3O2/c1-8-5-9(2)13(17(20)7-8)18-14(19)10(3)12(6-16-18)11(4)15/h5-7,11H,1-4H3