3-[4-(2,4-dimethylpentan-3-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(2,4-dimethylpentan-3-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(1-isopropyl-2-methyl-propoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-(2,4-dimethylpentan-3-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2,4-dimethylpentan-3-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(1-isopropyl-2-methyl-propoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C18H21F3N2O2 MolecularWeight: 354.36675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)OC1=C(C=C(C=C1)C2=NNC(=O)C=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(C(C)C)OC1=C(C=C(C=C1)C2=NNC(=O)C=C2)C(F)(F)F

InChI

InChI=1S/C18H21F3N2O2/c1-10(2)17(11(3)4)25-15-7-5-12(9-13(15)18(19,20)21)14-6-8-16(24)23-22-14/h5-11,17H,1-4H3,(H,23,24)