ethyl [4-(thiolan-1-ium-1-yl)naphthalen-1-yl] carbonate; tris(fluoranyl)methanesulfonate

Systemtic Name: ethyl [4-(thiolan-1-ium-1-yl)naphthalen-1-yl] carbonate; tris(fluoranyl)methanesulfonate Openeye Name: ethyl (4-tetrahydrothiophen-1-ium-1-yl-1-naphthyl) carbonate; trifluoromethanesulfonate CAS Name: carbonic acid ethyl [4-(1-thiolan-1-iumyl)-1-naphthalenyl] ester; trifluoromethanesulfonate IUPAC Name: ethyl [4-(thiolan-1-ium-1-yl)naphthalen-1-yl] carbonate; trifluoromethanesulfonate Traditional Name: carbonic acid ethyl (4-tetrahydrothiophen-1-ium-1-yl-1-naphthyl) ester triflate Formula: C18H19F3O6S2 MolecularWeight: 452.46507

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=CC=C(C2=CC=CC=C21)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCOC(=O)OC1=CC=C(C2=CC=CC=C21)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C17H19O3S.CHF3O3S/c1-2-19-17(18)20-15-9-10-16(21-11-5-6-12-21)14-8-4-3-7-13(14)15;2-1(3,4)8(5,6)7/h3-4,7-10H,2,5-6,11-12H2,1H3;(H,5,6,7)/q+1;/p-1