1-[(4-methoxyphenyl)methyl]thiolan-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 1-[(4-methoxyphenyl)methyl]thiolan-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 1-[(4-methoxyphenyl)methyl]tetrahydrothiophen-1-ium; trifluoromethanesulfonate CAS Name: 1-[(4-methoxyphenyl)methyl]thiolan-1-ium; trifluoromethanesulfonate IUPAC Name: 1-[(4-methoxyphenyl)methyl]thiolan-1-ium; trifluoromethanesulfonate Traditional Name: 1-p-anisyltetrahydrothiophen-1-ium triflate Formula: C13H17F3O4S2 MolecularWeight: 358.39689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[S+]2CCCC2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[S+]2CCCC2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H17OS.CHF3O3S/c1-13-12-6-4-11(5-7-12)10-14-8-2-3-9-14;2-1(3,4)8(5,6)7/h4-7H,2-3,8-10H2,1H3;(H,5,6,7)/q+1;/p-1