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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F)O

Isomeric SMILES

CC(C1CCN(CC1)C2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F)O

InChI

InChI=1S/C18H20F3N3O2/c1-11(25)12-6-8-24(9-7-12)16-4-2-13(10-14(16)18(19,20)21)15-3-5-17(26)23-22-15/h2-5,10-12,25H,6-9H2,1H3,(H,23,26)