11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonylundecan-1-ol

Systemtic Name: 11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonylundecan-1-ol Openeye Name: 11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonylundecan-1-ol CAS Name: 11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonyl-1-undecanol IUPAC Name: 11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonylundecan-1-ol Traditional Name: 11-[2,3,4,5,6-pentakis(tridecylsulfonyl)phenyl]sulfonylundecan-1-ol Formula: C82H158O13S6 MolecularWeight: 1544.51412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C82H158O13S6/c1-6-11-16-21-26-31-36-43-50-57-64-71-96(84,85)77-78(97(86,87)72-65-58-51-44-37-32-27-22-17-12-7-2)80(99(90,91)74-67-60-53-46-39-34-29-24-19-14-9-4)82(101(94,95)76-69-62-55-48-41-42-49-56-63-70-83)81(100(92,93)75-68-61-54-47-40-35-30-25-20-15-10-5)79(77)98(88,89)73-66-59-52-45-38-33-28-23-18-13-8-3/h83H,6-76H2,1-5H3