(4-cyanonaphthalen-1-yl)methyl-methyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (4-cyanonaphthalen-1-yl)methyl-methyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: (4-cyano-1-naphthyl)methyl-methyl-sulfonium; trifluoromethanesulfonate CAS Name: (4-cyano-1-naphthalenyl)methyl-methylsulfonium; trifluoromethanesulfonate IUPAC Name: (4-cyanonaphthalen-1-yl)methyl-methylsulfanium; trifluoromethanesulfonate Traditional Name: (4-cyano-1-naphthyl)methyl-methyl-sulfonium triflate Formula: C14H12F3NO3S2 MolecularWeight: 363.37519

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Descriptors Computed from Structure

Canonical SMILES:

C[SH+]CC1=CC=C(C2=CC=CC=C12)C#N.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[SH+]CC1=CC=C(C2=CC=CC=C12)C#N.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C13H11NS.CHF3O3S/c1-15-9-11-7-6-10(8-14)12-4-2-3-5-13(11)12;2-1(3,4)8(5,6)7/h2-7H,9H2,1H3;(H,5,6,7)