2,3-dimethyl-1-phenyl-1-benzothiophen-1-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2,3-dimethyl-1-phenyl-1-benzothiophen-1-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2,3-dimethyl-1-phenyl-benzothiophen-1-ium; trifluoromethanesulfonate CAS Name: 2,3-dimethyl-1-phenyl-1-benzothiophen-1-ium; trifluoromethanesulfonate IUPAC Name: 2,3-dimethyl-1-phenyl-1-benzothiophen-1-ium; trifluoromethanesulfonate Traditional Name: 2,3-dimethyl-1-phenyl-benzothiophen-1-ium triflate Formula: C17H15F3O3S2 MolecularWeight: 388.42441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([S+](C2=CC=CC=C12)C3=CC=CC=C3)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC1=C([S+](C2=CC=CC=C12)C3=CC=CC=C3)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C16H15S.CHF3O3S/c1-12-13(2)17(14-8-4-3-5-9-14)16-11-7-6-10-15(12)16;2-1(3,4)8(5,6)7/h3-11H,1-2H3;(H,5,6,7)/q+1;/p-1