[1,8-bis(oxidanyl)-9-oxidanylidene-xanthen-3-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [1,8-bis(oxidanyl)-9-oxidanylidene-xanthen-3-yl] tris(fluoranyl)methanesulfonate Openeye Name: (1,8-dihydroxy-9-oxo-xanthen-3-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (1,8-dihydroxy-9-oxo-3-xanthenyl) ester IUPAC Name: (1,8-dihydroxy-9-oxoxanthen-3-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (1,8-dihydroxy-9-keto-xanthen-3-yl) ester Formula: C14H7F3O7S MolecularWeight: 376.26139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3O2)OS(=O)(=O)C(F)(F)F)O

Isomeric SMILES

C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3O2)OS(=O)(=O)C(F)(F)F)O

InChI

InChI=1S/C14H7F3O7S/c15-14(16,17)25(21,22)24-6-4-8(19)12-10(5-6)23-9-3-1-2-7(18)11(9)13(12)20/h1-5,18-19H