2-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]pyran-4-one

Systemtic Name: 2-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]pyran-4-one Openeye Name: 2-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]pyran-4-one CAS Name: 2-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]-4-pyranone IUPAC Name: 2-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methoxy]pyran-4-one Traditional Name: 2-methylol-5-[3-(trifluoromethyl)benzyl]oxy-pyran-4-one Formula: C14H11F3O4 MolecularWeight: 300.22995

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)COC2=COC(=CC2=O)CO

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)COC2=COC(=CC2=O)CO

InChI

InChI=1S/C14H11F3O4/c15-14(16,17)10-3-1-2-9(4-10)7-21-13-8-20-11(6-18)5-12(13)19/h1-5,8,18H,6-7H2