[1-ethoxy-2,2,3,3,3-pentakis(fluoranyl)propyl] 4-methylbenzenesulfonate

Systemtic Name: [1-ethoxy-2,2,3,3,3-pentakis(fluoranyl)propyl] 4-methylbenzenesulfonate Openeye Name: (1-ethoxy-2,2,3,3,3-pentafluoro-propyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-ethoxy-2,2,3,3,3-pentafluoropropyl) ester IUPAC Name: (1-ethoxy-2,2,3,3,3-pentafluoropropyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-ethoxy-2,2,3,3,3-pentafluoro-propyl) ester Formula: C12H13F5O4S MolecularWeight: 348.286236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(C(F)(F)F)(F)F)OS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(C(C(F)(F)F)(F)F)OS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C12H13F5O4S/c1-3-20-10(11(13,14)12(15,16)17)21-22(18,19)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3