3-[4-[(1-methylpiperidin-3-yl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-[(1-methylpiperidin-3-yl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-[(1-methyl-3-piperidyl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-[(1-methyl-3-piperidinyl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[(1-methylpiperidin-3-yl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[(1-methyl-3-piperidyl)methoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C18H20F3N3O2 MolecularWeight: 367.36551

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)COC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CN1CCCC(C1)COC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C18H20F3N3O2/c1-24-8-2-3-12(10-24)11-26-16-6-4-13(9-14(16)18(19,20)21)15-5-7-17(25)23-22-15/h4-7,9,12H,2-3,8,10-11H2,1H3,(H,23,25)