19-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylnonadecan-1-ol

Systemtic Name: 19-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylnonadecan-1-ol Openeye Name: 19-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylnonadecan-1-ol CAS Name: 19-[[3,6,7,10,11-pentakis(hexylthio)-2-triphenylenyl]thio]-1-nonadecanol IUPAC Name: 19-[3,6,7,10,11-pentakis(hexylsulfanyl)triphenylen-2-yl]sulfanylnonadecan-1-ol Traditional Name: 19-[[3,6,7,10,11-pentakis(hexylthio)triphenylen-2-yl]thio]nonadecan-1-ol Formula: C67H110OS6 MolecularWeight: 1123.9797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C67H110OS6/c1-6-11-16-37-44-69-62-50-56-57-51-63(70-45-38-17-12-7-2)65(72-47-40-19-14-9-4)53-59(57)61-55-67(74-49-42-35-33-31-29-27-25-23-21-22-24-26-28-30-32-34-36-43-68)66(73-48-41-20-15-10-5)54-60(61)58(56)52-64(62)71-46-39-18-13-8-3/h50-55,68H,6-49H2,1-5H3