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1-octadecoxyoctadecane; propane-1-sulfonic acid

1-octadecoxyoctadecane; propane-1-sulfonic acid

Systemtic Name:1-octadecoxyoctadecane; propane-1-sulfonic acid
Openeye Name:1-octadecoxyoctadecane; propane-1-sulfonic acid
CAS Name:1-octadecoxyoctadecane; 1-propanesulfonic acid
IUPAC Name:1-octadecoxyoctadecane; propane-1-sulfonic acid
Traditional Name:propane-1-sulfonic acid; 1-stearyloxyoctadecane
Formula: C39H82O4S
MolecularWeight: 647.13098
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC.CCCS(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC.CCCS(=O)(=O)O


InChI

InChI=1S/C36H74O.C3H8O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2-3-7(4,5)6/h3-36H2,1-2H3;2-3H2,1H3,(H,4,5,6)


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