[4-(2-dibenzothiophen-3-ylethynyl)-2-ethyl-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(2-dibenzothiophen-3-ylethynyl)-2-ethyl-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-(2-dibenzothiophen-3-ylethynyl)-2-ethyl-phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-[2-(3-dibenzothiophenyl)ethynyl]-2-ethylphenyl] ester IUPAC Name: [4-(2-dibenzothiophen-3-ylethynyl)-2-ethylphenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(2-dibenzothiophen-3-ylethynyl)-2-ethyl-phenyl] ester Formula: C23H15F3O3S2 MolecularWeight: 460.48861

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C#CC2=CC3=C(C=C2)C4=CC=CC=C4S3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCC1=C(C=CC(=C1)C#CC2=CC3=C(C=C2)C4=CC=CC=C4S3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C23H15F3O3S2/c1-2-17-13-15(10-12-20(17)29-31(27,28)23(24,25)26)7-8-16-9-11-19-18-5-3-4-6-21(18)30-22(19)14-16/h3-6,9-14H,2H2,1H3