methyl-[(4-nitrophenyl)methyl]-phenyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: methyl-[(4-nitrophenyl)methyl]-phenyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: methyl-[(4-nitrophenyl)methyl]-phenyl-sulfonium; trifluoromethanesulfonate CAS Name: methyl-[(4-nitrophenyl)methyl]-phenylsulfonium; trifluoromethanesulfonate IUPAC Name: methyl-[(4-nitrophenyl)methyl]-phenylsulfanium; trifluoromethanesulfonate Traditional Name: methyl-(4-nitrobenzyl)-phenyl-sulfonium triflate Formula: C15H14F3NO5S2 MolecularWeight: 409.40057

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](CC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[S+](CC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H14NO2S.CHF3O3S/c1-18(14-5-3-2-4-6-14)11-12-7-9-13(10-8-12)15(16)17;2-1(3,4)8(5,6)7/h2-10H,11H2,1H3;(H,5,6,7)/q+1;/p-1