(E,2R,6R,7R)-7-[[4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecoxy]phenyl]methoxy]-2,6-dimethyl-oct-4-enal

Systemtic Name: (E,2R,6R,7R)-7-[[4-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecoxy]phenyl]methoxy]-2,6-dimethyl-oct-4-enal Openeye Name: (E,2R,6R,7R)-7-[[4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)phenyl]methoxy]-2,6-dimethyl-oct-4-enal CAS Name: (E,2R,6R,7R)-7-[[4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)phenyl]methoxy]-2,6-dimethyl-4-octenal IUPAC Name: (E,2R,6R,7R)-7-[[4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)phenyl]methoxy]-2,6-dimethyloct-4-enal Traditional Name: (E,2R,6R,7R)-7-[4-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecoxy)benzyl]oxy-2,6-dimethyl-oct-4-enal Formula: C28H29F17O3 MolecularWeight: 736.500914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC(C)C(C)OCC1=CC=C(C=C1)OCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=O

Isomeric SMILES

C[C@H](C/C=C/[C@@H](C)[C@@H](C)OCC1=CC=C(C=C1)OCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=O

InChI

InChI=1S/C28H29F17O3/c1-16(14-46)6-4-7-17(2)18(3)48-15-19-8-10-20(11-9-19)47-13-5-12-21(29,30)22(31,32)23(33,34)24(35,36)25(37,38)26(39,40)27(41,42)28(43,44)45/h4,7-11,14,16-18H,5-6,12-13,15H2,1-3H3/b7-4+/t16-,17-,18-/m1/s1