1-methyl-4-[4-(2-oxidanyl-4-pyridin-3-yl-butoxy)phenyl]-3-(trifluoromethyl)pyridin-2-one

Systemtic Name: 1-methyl-4-[4-(2-oxidanyl-4-pyridin-3-yl-butoxy)phenyl]-3-(trifluoromethyl)pyridin-2-one Openeye Name: 4-[4-[2-hydroxy-4-(3-pyridyl)butoxy]phenyl]-1-methyl-3-(trifluoromethyl)pyridin-2-one CAS Name: 4-[4-[2-hydroxy-4-(3-pyridinyl)butoxy]phenyl]-1-methyl-3-(trifluoromethyl)-2-pyridinone IUPAC Name: 4-[4-(2-hydroxy-4-pyridin-3-ylbutoxy)phenyl]-1-methyl-3-(trifluoromethyl)pyridin-2-one Traditional Name: 4-[4-[2-hydroxy-4-(3-pyridyl)butoxy]phenyl]-1-methyl-3-(trifluoromethyl)-2-pyridone Formula: C22H21F3N2O3 MolecularWeight: 418.40895

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C(C1=O)C(F)(F)F)C2=CC=C(C=C2)OCC(CCC3=CN=CC=C3)O

Isomeric SMILES

CN1C=CC(=C(C1=O)C(F)(F)F)C2=CC=C(C=C2)OCC(CCC3=CN=CC=C3)O

InChI

InChI=1S/C22H21F3N2O3/c1-27-12-10-19(20(21(27)29)22(23,24)25)16-5-8-18(9-6-16)30-14-17(28)7-4-15-3-2-11-26-13-15/h2-3,5-6,8-13,17,28H,4,7,14H2,1H3