2-(1-phenylthiolan-1-ium-3-yl)oxyoxane; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-(1-phenylthiolan-1-ium-3-yl)oxyoxane; tris(fluoranyl)methanesulfonate Openeye Name: 2-(1-phenyltetrahydrothiophen-1-ium-3-yl)oxytetrahydropyran; trifluoromethanesulfonate CAS Name: 2-[(1-phenyl-3-thiolan-1-iumyl)oxy]oxane; trifluoromethanesulfonate IUPAC Name: 2-(1-phenylthiolan-1-ium-3-yl)oxyoxane; trifluoromethanesulfonate Traditional Name: 2-(1-phenyltetrahydrothiophen-1-ium-3-yl)oxytetrahydropyran triflate Formula: C16H21F3O5S2 MolecularWeight: 414.46015

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC2CC[S+](C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CCOC(C1)OC2CC[S+](C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C15H21O2S.CHF3O3S/c1-2-6-14(7-3-1)18-11-9-13(12-18)17-15-8-4-5-10-16-15;2-1(3,4)8(5,6)7/h1-3,6-7,13,15H,4-5,8-12H2;(H,5,6,7)/q+1;/p-1