1,1,2,2,3,3-hexakis(decan-3-ylsulfonyl)propan-1-ol

Systemtic Name: 1,1,2,2,3,3-hexakis(decan-3-ylsulfonyl)propan-1-ol Openeye Name: 1,1,2,2,3,3-hexakis(1-ethyloctylsulfonyl)propan-1-ol CAS Name: 1,1,2,2,3,3-hexakis(decan-3-ylsulfonyl)-1-propanol IUPAC Name: 1,1,2,2,3,3-hexakis(decan-3-ylsulfonyl)propan-1-ol Traditional Name: 1,1,2,2,3,3-hexakis(1-ethyloctylsulfonyl)propan-1-ol Formula: C63H128O13S6 MolecularWeight: 1286.07262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC)S(=O)(=O)C(C(C(O)(S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC)(S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC

Isomeric SMILES

CCCCCCCC(CC)S(=O)(=O)C(C(C(O)(S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC)(S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC)S(=O)(=O)C(CC)CCCCCCC

InChI

InChI=1S/C63H128O13S6/c1-13-25-31-37-43-49-55(19-7)77(65,66)61(78(67,68)56(20-8)50-44-38-32-26-14-2)62(79(69,70)57(21-9)51-45-39-33-27-15-3,80(71,72)58(22-10)52-46-40-34-28-16-4)63(64,81(73,74)59(23-11)53-47-41-35-29-17-5)82(75,76)60(24-12)54-48-42-36-30-18-6/h55-61,64H,13-54H2,1-12H3