3-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonylpropan-1-ol

Systemtic Name: 3-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonylpropan-1-ol Openeye Name: 3-[4-[(E)-2-(2,4-dioctadecoxyphenyl)vinyl]phenyl]sulfonylpropan-1-ol CAS Name: 3-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonyl-1-propanol IUPAC Name: 3-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonylpropan-1-ol Traditional Name: 3-[4-[(E)-2-(2,4-distearyloxyphenyl)vinyl]phenyl]sulfonylpropan-1-ol Formula: C53H90O5S MolecularWeight: 839.3437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)CCCO)OCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)CCCO)OCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C53H90O5S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-45-57-51-41-40-50(39-36-49-37-42-52(43-38-49)59(55,56)47-35-44-54)53(48-51)58-46-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h36-43,48,54H,3-35,44-47H2,1-2H3/b39-36+