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

Systemtic Name: 3-[4-(2-methylbutan-2-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(1,1-dimethylpropoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-(2-methylbutan-2-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2-methylbutan-2-yloxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-tert-amyloxy-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C16H17F3N2O2 MolecularWeight: 326.31359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17F3N2O2/c1-4-15(2,3)23-13-7-5-10(9-11(13)16(17,18)19)12-6-8-14(22)21-20-12/h5-9H,4H2,1-3H3,(H,21,22)