3-naphthalen-1-yl-1,4-dithioniabicyclo[2.2.2]octane; tris(fluoranyl)methanesulfonate

Systemtic Name: 3-naphthalen-1-yl-1,4-dithioniabicyclo[2.2.2]octane; tris(fluoranyl)methanesulfonate Openeye Name: 3-(1-naphthyl)-1,4-dithioniabicyclo[2.2.2]octane; trifluoromethanesulfonate CAS Name: 3-(1-naphthalenyl)-1,4-dithioniabicyclo[2.2.2]octane; trifluoromethanesulfonate IUPAC Name: 3-naphthalen-1-yl-1,4-dithioniabicyclo[2.2.2]octane; trifluoromethanesulfonate Traditional Name: 3-(1-naphthyl)-1,4-dithioniabicyclo[2.2.2]octane ditriflate Formula: C18H18F6O6S4 MolecularWeight: 572.582339

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Descriptors Computed from Structure

Canonical SMILES:

C1C[S+]2CC[S+]1CC2C3=CC=CC4=CC=CC=C43.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1C[S+]2CC[S+]1CC2C3=CC=CC4=CC=CC=C43.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C16H18S2.2CHF3O3S/c1-2-6-14-13(4-1)5-3-7-15(14)16-12-17-8-10-18(16)11-9-17;2*2-1(3,4)8(5,6)7/h1-7,16H,8-12H2;2*(H,5,6,7)/q+2;;/p-2