2-dodec-11-enylsulfanyl-3,6,7,10,11-pentakis(octylsulfanyl)triphenylene

Systemtic Name: 2-dodec-11-enylsulfanyl-3,6,7,10,11-pentakis(octylsulfanyl)triphenylene Openeye Name: 2-dodec-11-enylsulfanyl-3,6,7,10,11-pentakis(octylsulfanyl)triphenylene CAS Name: 2-(dodec-11-enylthio)-3,6,7,10,11-pentakis(octylthio)triphenylene IUPAC Name: 2-dodec-11-enylsulfanyl-3,6,7,10,11-pentakis(octylsulfanyl)triphenylene Traditional Name: 2-(dodec-11-enylthio)-3,6,7,10,11-pentakis(octylthio)triphenylene Formula: C70H114S6 MolecularWeight: 1148.04416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCCCC)SCCCCCCCCCCC=C)SCCCCCCCC)SCCCCCCCC)SCCCCCCCC

Isomeric SMILES

CCCCCCCCSC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)SCCCCCCCC)SCCCCCCCCCCC=C)SCCCCCCCC)SCCCCCCCC)SCCCCCCCC

InChI

InChI=1S/C70H114S6/c1-7-13-19-25-31-32-33-34-40-46-52-76-70-58-64-62-56-68(74-50-44-38-29-23-17-11-5)66(72-48-42-36-27-21-15-9-3)54-60(62)59-53-65(71-47-41-35-26-20-14-8-2)67(73-49-43-37-28-22-16-10-4)55-61(59)63(64)57-69(70)75-51-45-39-30-24-18-12-6/h7,53-58H,1,8-52H2,2-6H3