8-fluoranyl-2-methoxy-3-(trifluoromethylsulfanyloxyperoxy)-6H-benzo[b][1]benzoxepin-5-one

Systemtic Name: 8-fluoranyl-2-methoxy-3-(trifluoromethylsulfanyloxyperoxy)-6H-benzo[b][1]benzoxepin-5-one Openeye Name: 8-fluoro-2-methoxy-3-(trifluoromethylsulfanyloxyperoxy)-6H-benzo[b][1]benzoxepin-5-one CAS Name: trifluoromethanesulfenic acid (8-fluoro-2-methoxy-5-oxo-6H-benzo[b][1]benzoxepin-3-yl)dioxy ester IUPAC Name: 8-fluoro-2-methoxy-3-(trifluoromethylsulfanyloxyperoxy)-6H-benzo[b][1]benzoxepin-5-one Traditional Name: 8-fluoro-2-methoxy-3-(trifluoromethylthio)oxyperoxy-6H-benzo[b][1]benzoxepin-5-one Formula: C16H10F4O6S MolecularWeight: 406.305613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=O)CC3=C(C=CC(=C3)F)OC2=C1)OOOSC(F)(F)F

Isomeric SMILES

COC1=C(C=C2C(=O)CC3=C(C=CC(=C3)F)OC2=C1)OOOSC(F)(F)F

InChI

InChI=1S/C16H10F4O6S/c1-22-14-7-13-10(6-15(14)24-25-26-27-16(18,19)20)11(21)5-8-4-9(17)2-3-12(8)23-13/h2-4,6-7H,5H2,1H3