3-[3-(trifluoromethyl)-4-(trifluoromethyloxy)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-(trifluoromethyl)-4-(trifluoromethyloxy)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(trifluoromethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-(trifluoromethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(trifluoromethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(trifluoromethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C12H6F6N2O2 MolecularWeight: 324.178659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NNC(=O)C=C2)C(F)(F)F)OC(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C2=NNC(=O)C=C2)C(F)(F)F)OC(F)(F)F

InChI

InChI=1S/C12H6F6N2O2/c13-11(14,15)7-5-6(8-2-4-10(21)20-19-8)1-3-9(7)22-12(16,17)18/h1-5H,(H,20,21)