(4-oxidanylidene-2,2-diphenyl-1,3-benzodioxin-5-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4-oxidanylidene-2,2-diphenyl-1,3-benzodioxin-5-yl) tris(fluoranyl)methanesulfonate Openeye Name: (4-oxo-2,2-diphenyl-1,3-benzodioxin-5-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (4-oxo-2,2-diphenyl-1,3-benzodioxin-5-yl) ester IUPAC Name: (4-oxo-2,2-diphenyl-1,3-benzodioxin-5-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-keto-2,2-diphenyl-1,3-benzodioxin-5-yl) ester Formula: C21H13F3O6S MolecularWeight: 450.38453

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(OC3=C(C(=CC=C3)OS(=O)(=O)C(F)(F)F)C(=O)O2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2(OC3=C(C(=CC=C3)OS(=O)(=O)C(F)(F)F)C(=O)O2)C4=CC=CC=C4

InChI

InChI=1S/C21H13F3O6S/c22-21(23,24)31(26,27)30-17-13-7-12-16-18(17)19(25)29-20(28-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H