1-(4-tert-butylphenyl)thiolan-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-(4-tert-butylphenyl)thiolan-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-(4-tert-butylphenyl)tetrahydrothiophen-1-ium; trifluoromethanesulfonate CAS Name: 1-(4-tert-butylphenyl)thiolan-1-ium; trifluoromethanesulfonate IUPAC Name: 1-(4-tert-butylphenyl)thiolan-1-ium; trifluoromethanesulfonate Traditional Name: 1-(4-tert-butylphenyl)tetrahydrothiophen-1-ium triflate Formula: C15H21F3O3S2 MolecularWeight: 370.45065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)[S+]2CCCC2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[S+]2CCCC2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H21S.CHF3O3S/c1-14(2,3)12-6-8-13(9-7-12)15-10-4-5-11-15;2-1(3,4)8(5,6)7/h6-9H,4-5,10-11H2,1-3H3;(H,5,6,7)/q+1;/p-1