[4-[2-(4-propylphenyl)ethynyl]phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-[2-(4-propylphenyl)ethynyl]phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-[2-(4-propylphenyl)ethynyl]phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-[2-(4-propylphenyl)ethynyl]phenyl] ester IUPAC Name: [4-[2-(4-propylphenyl)ethynyl]phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-[2-(4-propylphenyl)ethynyl]phenyl] ester Formula: C18H15F3O3S MolecularWeight: 368.37011

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C18H15F3O3S/c1-2-3-14-4-6-15(7-5-14)8-9-16-10-12-17(13-11-16)24-25(22,23)18(19,20)21/h4-7,10-13H,2-3H2,1H3