1-[4-(4H-1,3-benzodioxin-4-yl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]quinolin-4-one

Systemtic Name: 1-[4-(4H-1,3-benzodioxin-4-yl)-4-methyl-2-oxidanyl-2-(trifluoromethyl)pentyl]quinolin-4-one Openeye Name: 1-[4-(4H-1,3-benzodioxin-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]quinolin-4-one CAS Name: 1-[4-(4H-1,3-benzodioxin-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-quinolinone IUPAC Name: 1-[4-(4H-1,3-benzodioxin-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]quinolin-4-one Traditional Name: 1-[4-(4H-1,3-benzodioxin-4-yl)-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]-4-quinolone Formula: C24H24F3NO4 MolecularWeight: 447.44687

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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)C3C4=CC=CC=C4OCO3

Isomeric SMILES

CC(C)(CC(CN1C=CC(=O)C2=CC=CC=C21)(C(F)(F)F)O)C3C4=CC=CC=C4OCO3

InChI

InChI=1S/C24H24F3NO4/c1-22(2,21-17-8-4-6-10-20(17)31-15-32-21)13-23(30,24(25,26)27)14-28-12-11-19(29)16-7-3-5-9-18(16)28/h3-12,21,30H,13-15H2,1-2H3