6-[4-[(E)-2-[4-(dihexadecylamino)phenyl]ethenyl]phenyl]sulfonylhexan-1-ol

Systemtic Name: 6-[4-[(E)-2-[4-(dihexadecylamino)phenyl]ethenyl]phenyl]sulfonylhexan-1-ol Openeye Name: 6-[4-[(E)-2-[4-(dihexadecylamino)phenyl]vinyl]phenyl]sulfonylhexan-1-ol CAS Name: 6-[4-[(E)-2-[4-(dihexadecylamino)phenyl]ethenyl]phenyl]sulfonyl-1-hexanol IUPAC Name: 6-[4-[(E)-2-[4-(dihexadecylamino)phenyl]ethenyl]phenyl]sulfonylhexan-1-ol Traditional Name: 6-[4-[(E)-2-[4-(dicetylamino)phenyl]vinyl]phenyl]sulfonylhexan-1-ol Formula: C52H89NO3S MolecularWeight: 808.33296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)C1=CC=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)CCCCCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)CCCCCCO

InChI

InChI=1S/C52H89NO3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-45-53(46-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2)51-41-37-49(38-42-51)35-36-50-39-43-52(44-40-50)57(55,56)48-34-30-29-33-47-54/h35-44,54H,3-34,45-48H2,1-2H3/b36-35+