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

Systemtic Name: 3-[4-(1-piperidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-[1-(1-piperidyl)ethoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-[1-(1-piperidinyl)ethoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(1-piperidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(1-piperidinoethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C18H20F3N3O2 MolecularWeight: 367.36551

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCCC1)OC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

CC(N1CCCCC1)OC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C18H20F3N3O2/c1-12(24-9-3-2-4-10-24)26-16-7-5-13(11-14(16)18(19,20)21)15-6-8-17(25)23-22-15/h5-8,11-12H,2-4,9-10H2,1H3,(H,23,25)