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

Systemtic Name: 2,3,6,7,10,11-hexakis(3,7-dimethyloctoxy)triphenylene Openeye Name: 2,3,6,7,10,11-hexakis(3,7-dimethyloctoxy)triphenylene CAS Name: 2,3,6,7,10,11-hexakis(3,7-dimethyloctoxy)triphenylene IUPAC Name: 2,3,6,7,10,11-hexakis(3,7-dimethyloctoxy)triphenylene Traditional Name: 2,3,6,7,10,11-hexakis(3,7-dimethyloctoxy)triphenylene Formula: C78H132O6 MolecularWeight: 1165.87908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C

Isomeric SMILES

CC(C)CCCC(C)CCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C)OCCC(C)CCCC(C)C

InChI

InChI=1S/C78H132O6/c1-55(2)25-19-31-61(13)37-43-79-73-49-67-68(50-74(73)80-44-38-62(14)32-20-26-56(3)4)70-52-76(82-46-40-64(16)34-22-28-58(7)8)78(84-48-42-66(18)36-24-30-60(11)12)54-72(70)71-53-77(83-47-41-65(17)35-23-29-59(9)10)75(51-69(67)71)81-45-39-63(15)33-21-27-57(5)6/h49-66H,19-48H2,1-18H3