4-fluoranylbenzenesulfonate; (9-oxidanylidenexanthen-2-yl)-diphenyl-sulfanium

Systemtic Name: 4-fluoranylbenzenesulfonate; (9-oxidanylidenexanthen-2-yl)-diphenyl-sulfanium Openeye Name: 4-fluorobenzenesulfonate; (9-oxoxanthen-2-yl)-diphenyl-sulfonium CAS Name: 4-fluorobenzenesulfonate; (9-oxo-2-xanthenyl)-diphenylsulfonium IUPAC Name: 4-fluorobenzenesulfonate; (9-oxoxanthen-2-yl)-diphenylsulfanium Traditional Name: 4-fluorobesylate; (9-ketoxanthen-2-yl)-diphenyl-sulfonium Formula: C31H21FO5S2 MolecularWeight: 556.623843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=CC=CC=C5C4=O.C1=CC(=CC=C1F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=CC=CC=C5C4=O.C1=CC(=CC=C1F)S(=O)(=O)[O-]

InChI

InChI=1S/C25H17O2S.C6H5FO3S/c26-25-21-13-7-8-14-23(21)27-24-16-15-20(17-22(24)25)28(18-9-3-1-4-10-18)19-11-5-2-6-12-19;7-5-1-3-6(4-2-5)11(8,9)10/h1-17H;1-4H,(H,8,9,10)/q+1;/p-1