1-[4-cyclohexyl-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]quinolin-4-one

Systemtic Name: 1-[4-cyclohexyl-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]quinolin-4-one Openeye Name: 1-[4-cyclohexyl-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]quinolin-4-one CAS Name: 1-[4-cyclohexyl-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-quinolinone IUPAC Name: 1-[4-cyclohexyl-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]quinolin-4-one Traditional Name: 1-[4-cyclohexyl-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-quinolone Formula: C22H28F3NO2 MolecularWeight: 395.45843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CN1C=CC(=O)C2=CC=CC=C21)(C(F)(F)F)O)C3CCCCC3

Isomeric SMILES

CC(C)(CC(CN1C=CC(=O)C2=CC=CC=C21)(C(F)(F)F)O)C3CCCCC3

InChI

InChI=1S/C22H28F3NO2/c1-20(2,16-8-4-3-5-9-16)14-21(28,22(23,24)25)15-26-13-12-19(27)17-10-6-7-11-18(17)26/h6-7,10-13,16,28H,3-5,8-9,14-15H2,1-2H3