(4-tert-butylcyclohexen-1-yl) 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: (4-tert-butylcyclohexen-1-yl) 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: (4-tert-butylcyclohexen-1-yl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonic acid IUPAC Name: (4-tert-butylcyclohexen-1-yl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonic acid (4-tert-butylcyclohexen-1-yl) ester Formula: C14H17F9O3S MolecularWeight: 436.333609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=CC1)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CC(C)(C)C1CCC(=CC1)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C14H17F9O3S/c1-10(2,3)8-4-6-9(7-5-8)26-27(24,25)14(22,23)12(17,18)11(15,16)13(19,20)21/h6,8H,4-5,7H2,1-3H3