(1-phenylthiolan-1-ium-3-yl) propyl carbonate; tris(fluoranyl)methanesulfonate

Systemtic Name: (1-phenylthiolan-1-ium-3-yl) propyl carbonate; tris(fluoranyl)methanesulfonate Openeye Name: (1-phenyltetrahydrothiophen-1-ium-3-yl) propyl carbonate; trifluoromethanesulfonate CAS Name: carbonic acid (1-phenyl-3-thiolan-1-iumyl) propyl ester; trifluoromethanesulfonate IUPAC Name: (1-phenylthiolan-1-ium-3-yl) propyl carbonate; trifluoromethanesulfonate Traditional Name: carbonic acid (1-phenyltetrahydrothiophen-1-ium-3-yl) propyl ester triflate Formula: C15H19F3O6S2 MolecularWeight: 416.43297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)OC1CC[S+](C1)C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCOC(=O)OC1CC[S+](C1)C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H19O3S.CHF3O3S/c1-2-9-16-14(15)17-12-8-10-18(11-12)13-6-4-3-5-7-13;2-1(3,4)8(5,6)7/h3-7,12H,2,8-11H2,1H3;(H,5,6,7)/q+1;/p-1