2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene

Systemtic Name: 2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene Openeye Name: 2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene CAS Name: 2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene IUPAC Name: 2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene Traditional Name: 2,3,6,7,10,11-hexakis(decylsulfinyl)triphenylene Formula: C78H132O6S6 MolecularWeight: 1358.26908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCS(=O)C1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCS(=O)C1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC)S(=O)CCCCCCCCCC

InChI

InChI=1S/C78H132O6S6/c1-7-13-19-25-31-37-43-49-55-85(79)73-61-67-68(62-74(73)86(80)56-50-44-38-32-26-20-14-8-2)70-64-76(88(82)58-52-46-40-34-28-22-16-10-4)78(90(84)60-54-48-42-36-30-24-18-12-6)66-72(70)71-65-77(89(83)59-53-47-41-35-29-23-17-11-5)75(63-69(67)71)87(81)57-51-45-39-33-27-21-15-9-3/h61-66H,7-60H2,1-6H3