1,2,4,6,8,9-hexaoctoxydibenzothiophene

Systemtic Name: 1,2,4,6,8,9-hexaoctoxydibenzothiophene Openeye Name: 1,2,4,6,8,9-hexaoctoxydibenzothiophene CAS Name: 1,2,4,6,8,9-hexaoctoxydibenzothiophene IUPAC Name: 1,2,4,6,8,9-hexaoctoxydibenzothiophene Traditional Name: 1,2,4,6,8,9-hexaoctoxydibenzothiophene Formula: C60H104O6S MolecularWeight: 953.52916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C2C(=C1OCCCCCCCC)C3=C(C(=CC(=C3S2)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC(=C2C(=C1OCCCCCCCC)C3=C(C(=CC(=C3S2)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC)OCCCCCCCC

InChI

InChI=1S/C60H104O6S/c1-7-13-19-25-31-37-43-61-51-49-53(63-45-39-33-27-21-15-9-3)59-55(57(51)65-47-41-35-29-23-17-11-5)56-58(66-48-42-36-30-24-18-12-6)52(62-44-38-32-26-20-14-8-2)50-54(60(56)67-59)64-46-40-34-28-22-16-10-4/h49-50H,7-48H2,1-6H3