4-fluoranylbenzenesulfonate; tris[3-(1-ethoxyethoxy)phenyl]sulfanium

Systemtic Name: 4-fluoranylbenzenesulfonate; tris[3-(1-ethoxyethoxy)phenyl]sulfanium Openeye Name: 4-fluorobenzenesulfonate; tris[3-(1-ethoxyethoxy)phenyl]sulfonium CAS Name: 4-fluorobenzenesulfonate; tris[3-(1-ethoxyethoxy)phenyl]sulfonium IUPAC Name: 4-fluorobenzenesulfonate; tris[3-(1-ethoxyethoxy)phenyl]sulfanium Traditional Name: 4-fluorobesylate; tris[3-(1-ethoxyethoxy)phenyl]sulfonium Formula: C36H43FO9S2 MolecularWeight: 702.849623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OC1=CC(=CC=C1)[S+](C2=CC=CC(=C2)OC(C)OCC)C3=CC=CC(=C3)OC(C)OCC.C1=CC(=CC=C1F)S(=O)(=O)[O-]

Isomeric SMILES

CCOC(C)OC1=CC(=CC=C1)[S+](C2=CC=CC(=C2)OC(C)OCC)C3=CC=CC(=C3)OC(C)OCC.C1=CC(=CC=C1F)S(=O)(=O)[O-]

InChI

InChI=1S/C30H39O6S.C6H5FO3S/c1-7-31-22(4)34-25-13-10-16-28(19-25)37(29-17-11-14-26(20-29)35-23(5)32-8-2)30-18-12-15-27(21-30)36-24(6)33-9-3;7-5-1-3-6(4-2-5)11(8,9)10/h10-24H,7-9H2,1-6H3;1-4H,(H,8,9,10)/q+1;/p-1