8-[4-[(E)-2-(4-docosoxyphenyl)ethenyl]phenyl]sulfonyloctan-1-ol

Systemtic Name: 8-[4-[(E)-2-(4-docosoxyphenyl)ethenyl]phenyl]sulfonyloctan-1-ol Openeye Name: 8-[4-[(E)-2-(4-docosoxyphenyl)vinyl]phenyl]sulfonyloctan-1-ol CAS Name: 8-[4-[(E)-2-(4-docosoxyphenyl)ethenyl]phenyl]sulfonyl-1-octanol IUPAC Name: 8-[4-[(E)-2-(4-docosoxyphenyl)ethenyl]phenyl]sulfonyloctan-1-ol Traditional Name: 8-[4-[(E)-2-(4-behenyloxyphenyl)vinyl]phenyl]sulfonyloctan-1-ol Formula: C44H72O4S MolecularWeight: 697.10508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)CCCCCCCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)CCCCCCCCO

InChI

InChI=1S/C44H72O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23-26-39-48-43-34-30-41(31-35-43)28-29-42-32-36-44(37-33-42)49(46,47)40-27-24-21-19-22-25-38-45/h28-37,45H,2-27,38-40H2,1H3/b29-28+