1-[(4-cyano-2-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridazin-3-olate

Systemtic Name: 1-[(4-cyano-2-fluoranyl-phenyl)methyl]-6-oxidanylidene-pyridazin-3-olate Openeye Name: 1-[(4-cyano-2-fluoro-phenyl)methyl]-6-oxo-pyridazin-3-olate CAS Name: 1-[(4-cyano-2-fluorophenyl)methyl]-6-oxo-3-pyridazinolate IUPAC Name: 1-[(4-cyano-2-fluorophenyl)methyl]-6-oxopyridazin-3-olate Traditional Name: 1-(4-cyano-2-fluoro-benzyl)-6-keto-pyridazin-3-olate Formula: C12H7FN3O2- MolecularWeight: 244.201283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)CN2C(=O)C=CC(=N2)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)CN2C(=O)C=CC(=N2)[O-]

InChI

InChI=1S/C12H8FN3O2/c13-10-5-8(6-14)1-2-9(10)7-16-12(18)4-3-11(17)15-16/h1-5H,7H2,(H,15,17)/p-1