(2-cyanophenyl)methyl-(phenylmethyl)sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2-cyanophenyl)methyl-(phenylmethyl)sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: benzyl-[(2-cyanophenyl)methyl]sulfonium; trifluoromethanesulfonate CAS Name: (2-cyanophenyl)methyl-(phenylmethyl)sulfonium; trifluoromethanesulfonate IUPAC Name: benzyl-[(2-cyanophenyl)methyl]sulfanium; trifluoromethanesulfonate Traditional Name: benzyl-(2-cyanobenzyl)sulfonium triflate Formula: C16H14F3NO3S2 MolecularWeight: 389.41247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[SH+]CC2=CC=CC=C2C#N.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[SH+]CC2=CC=CC=C2C#N.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C15H13NS.CHF3O3S/c16-10-14-8-4-5-9-15(14)12-17-11-13-6-2-1-3-7-13;2-1(3,4)8(5,6)7/h1-9H,11-12H2;(H,5,6,7)