2,2,2-tris(fluoranyl)ethyl 4-bromanylbenzenesulfonate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 4-bromanylbenzenesulfonate Openeye Name: 2,2,2-trifluoroethyl 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid 2,2,2-trifluoroethyl ester Formula: C8H6BrF3O3S MolecularWeight: 319.09565

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)OCC(F)(F)F)Br

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)OCC(F)(F)F)Br

InChI

InChI=1S/C8H6BrF3O3S/c9-6-1-3-7(4-2-6)16(13,14)15-5-8(10,11)12/h1-4H,5H2