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

Systemtic Name: 2,3,6,7,10,11-hexakis(decylsulfonyl)triphenylene Openeye Name: 2,3,6,7,10,11-hexakis(decylsulfonyl)triphenylene CAS Name: 2,3,6,7,10,11-hexakis(decylsulfonyl)triphenylene IUPAC Name: 2,3,6,7,10,11-hexakis(decylsulfonyl)triphenylene Traditional Name: 2,3,6,7,10,11-hexakis(decylsulfonyl)triphenylene Formula: C78H132O12S6 MolecularWeight: 1454.26548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C78H132O12S6/c1-7-13-19-25-31-37-43-49-55-91(79,80)73-61-67-68(62-74(73)92(81,82)56-50-44-38-32-26-20-14-8-2)70-64-76(94(85,86)58-52-46-40-34-28-22-16-10-4)78(96(89,90)60-54-48-42-36-30-24-18-12-6)66-72(70)71-65-77(95(87,88)59-53-47-41-35-29-23-17-11-5)75(63-69(67)71)93(83,84)57-51-45-39-33-27-21-15-9-3/h61-66H,7-60H2,1-6H3