16-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexadecan-1-ol

Systemtic Name: 16-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexadecan-1-ol Openeye Name: 16-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexadecan-1-ol CAS Name: 16-[[3,6,7,10,11-pentakis(hexylthio)-2-triphenylenyl]thio]-1-hexadecanol IUPAC Name: 16-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylhexadecan-1-ol Traditional Name: 16-[[3,6,7,10,11-pentakis(hexylthio)triphenylen-2-yl]thio]hexadecan-1-ol Formula: C64H104OS6 MolecularWeight: 1081.89996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCC)SCCCCCCCCCCCCCCCCO)SCCCCCC)SCCCCCC)SCCCCCC

Isomeric SMILES

CCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCC)SCCCCCCCCCCCCCCCCO)SCCCCCC)SCCCCCC)SCCCCCC

InChI

InChI=1S/C64H104OS6/c1-6-11-16-34-41-66-59-47-53-54-48-60(67-42-35-17-12-7-2)62(69-44-37-19-14-9-4)50-56(54)58-52-64(71-46-39-32-30-28-26-24-22-21-23-25-27-29-31-33-40-65)63(70-45-38-20-15-10-5)51-57(58)55(53)49-61(59)68-43-36-18-13-8-3/h47-52,65H,6-46H2,1-5H3