3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C12H6F6N2O MolecularWeight: 308.179259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)NN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=O)NN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H6F6N2O/c13-11(14,15)7-3-6(4-8(5-7)12(16,17)18)9-1-2-10(21)20-19-9/h1-5H,(H,20,21)