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

Systemtic Name: 4-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonylbutan-1-ol Openeye Name: 4-[4-[(E)-2-(2,4-dioctadecoxyphenyl)vinyl]phenyl]sulfonylbutan-1-ol CAS Name: 4-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonyl-1-butanol IUPAC Name: 4-[4-[(E)-2-(2,4-dioctadecoxyphenyl)ethenyl]phenyl]sulfonylbutan-1-ol Traditional Name: 4-[4-[(E)-2-(2,4-distearyloxyphenyl)vinyl]phenyl]sulfonylbutan-1-ol Formula: C54H92O5S MolecularWeight: 853.37028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C54H92O5S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-46-58-52-42-41-51(40-37-50-38-43-53(44-39-50)60(56,57)48-36-33-45-55)54(49-52)59-47-35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-44,49,55H,3-36,45-48H2,1-2H3/b40-37+