(4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4-oxidanylidene-8-propyl-2,3-dihydrochromen-7-yl) tris(fluoranyl)methanesulfonate Openeye Name: (4-oxo-8-propyl-chroman-7-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (4-oxo-8-propyl-3,4-dihydro-2H-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-8-propyl-2,3-dihydrochromen-7-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-keto-8-propyl-chroman-7-yl) ester Formula: C13H13F3O5S MolecularWeight: 338.29953

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OCCC2=O)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCC1=C(C=CC2=C1OCCC2=O)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H13F3O5S/c1-2-3-9-11(21-22(18,19)13(14,15)16)5-4-8-10(17)6-7-20-12(8)9/h4-5H,2-3,6-7H2,1H3