1-oxidanyl-3-[[3-(trifluoromethyl)phenyl]methoxy]xanthen-9-one

Systemtic Name: 1-oxidanyl-3-[[3-(trifluoromethyl)phenyl]methoxy]xanthen-9-one Openeye Name: 1-hydroxy-3-[[3-(trifluoromethyl)phenyl]methoxy]xanthen-9-one CAS Name: 1-hydroxy-3-[[3-(trifluoromethyl)phenyl]methoxy]-9-xanthenone IUPAC Name: 1-hydroxy-3-[[3-(trifluoromethyl)phenyl]methoxy]xanthen-9-one Traditional Name: 1-hydroxy-3-[3-(trifluoromethyl)benzyl]oxy-xanthone Formula: C21H13F3O4 MolecularWeight: 386.32073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=C(C=C3O2)OCC4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=C(C=C3O2)OCC4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C21H13F3O4/c22-21(23,24)13-5-3-4-12(8-13)11-27-14-9-16(25)19-18(10-14)28-17-7-2-1-6-15(17)20(19)26/h1-10,25H,11H2