4-[1,1,1,4,4,5,5,5-octakis(fluoranyl)-2-(trifluoromethyl)pent-2-en-3-yl]oxybenzenesulfonic acid

Systemtic Name: 4-[1,1,1,4,4,5,5,5-octakis(fluoranyl)-2-(trifluoromethyl)pent-2-en-3-yl]oxybenzenesulfonic acid Openeye Name: 4-[3,3,3-trifluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)prop-1-enoxy]benzenesulfonic acid CAS Name: 4-[1,1,1,4,4,5,5,5-octafluoro-2-(trifluoromethyl)pent-2-en-3-yl]oxybenzenesulfonic acid IUPAC Name: 4-[1,1,1,4,4,5,5,5-octafluoro-2-(trifluoromethyl)pent-2-en-3-yl]oxybenzenesulfonic acid Traditional Name: 4-[3,3,3-trifluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)prop-1-enoxy]besylic acid Formula: C12H5F11O4S MolecularWeight: 454.213135

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)(F)F)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1OC(=C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)(F)F)S(=O)(=O)O

InChI

InChI=1S/C12H5F11O4S/c13-9(14,12(21,22)23)8(7(10(15,16)17)11(18,19)20)27-5-1-3-6(4-2-5)28(24,25)26/h1-4H,(H,24,25,26)