1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene

Systemtic Name: 1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene Openeye Name: 1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene CAS Name: 1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene IUPAC Name: 1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene Traditional Name: 1,2,3,4,5,6-hexakis(tridecylsulfinyl)benzene Formula: C84H162O6S6 MolecularWeight: 1460.57148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCS(=O)C1=C(C(=C(C(=C1S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCS(=O)C1=C(C(=C(C(=C1S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC)S(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C84H162O6S6/c1-7-13-19-25-31-37-43-49-55-61-67-73-91(85)79-80(92(86)74-68-62-56-50-44-38-32-26-20-14-8-2)82(94(88)76-70-64-58-52-46-40-34-28-22-16-10-4)84(96(90)78-72-66-60-54-48-42-36-30-24-18-12-6)83(95(89)77-71-65-59-53-47-41-35-29-23-17-11-5)81(79)93(87)75-69-63-57-51-45-39-33-27-21-15-9-3/h7-78H2,1-6H3