methyl 2-[3-[3-[3-[1,1,1,3,3,3-hexakis(fluoranyl)-2-oxidanyl-propan-2-yl]phenoxy]propoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[3-[3-[3-[1,1,1,3,3,3-hexakis(fluoranyl)-2-oxidanyl-propan-2-yl]phenoxy]propoxy]phenyl]ethanoate Openeye Name: methyl 2-[3-[3-[3-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenoxy]propoxy]phenyl]acetate CAS Name: 2-[3-[3-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenoxy]propoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[3-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenoxy]propoxy]phenyl]acetate Traditional Name: 2-[3-[3-[3-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenoxy]propoxy]phenyl]acetic acid methyl ester Formula: C21H20F6O5 MolecularWeight: 466.370919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)OCCCOC2=CC=CC(=C2)C(C(F)(F)F)(C(F)(F)F)O

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)OCCCOC2=CC=CC(=C2)C(C(F)(F)F)(C(F)(F)F)O

InChI

InChI=1S/C21H20F6O5/c1-30-18(28)12-14-5-2-7-16(11-14)31-9-4-10-32-17-8-3-6-15(13-17)19(29,20(22,23)24)21(25,26)27/h2-3,5-8,11,13,29H,4,9-10,12H2,1H3