tert-butyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; tris(fluoranyl)methanesulfonate

Systemtic Name: tert-butyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; tris(fluoranyl)methanesulfonate Openeye Name: tert-butyl (5-tetrahydrothiophen-1-ium-1-yl-2-naphthyl) carbonate; trifluoromethanesulfonate CAS Name: carbonic acid tert-butyl [5-(1-thiolan-1-iumyl)-2-naphthalenyl] ester; trifluoromethanesulfonate IUPAC Name: tert-butyl [5-(thiolan-1-ium-1-yl)naphthalen-2-yl] carbonate; trifluoromethanesulfonate Traditional Name: carbonic acid tert-butyl (5-tetrahydrothiophen-1-ium-1-yl-2-naphthyl) ester triflate Formula: C20H23F3O6S2 MolecularWeight: 480.51823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)C(=CC=C2)[S+]3CCCC3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C19H23O3S.CHF3O3S/c1-19(2,3)22-18(20)21-15-9-10-16-14(13-15)7-6-8-17(16)23-11-4-5-12-23;2-1(3,4)8(5,6)7/h6-10,13H,4-5,11-12H2,1-3H3;(H,5,6,7)/q+1;/p-1