bis[2-(2-hydroxyethyloxy)ethyl]-methyl-octadecyl-azanium; methyl sulfate

Systemtic Name: bis[2-(2-hydroxyethyloxy)ethyl]-methyl-octadecyl-azanium; methyl sulfate Openeye Name: bis[2-(2-hydroxyethoxy)ethyl]-methyl-octadecyl-ammonium; methyl sulfate CAS Name: bis[2-(2-hydroxyethoxy)ethyl]-methyl-octadecylammonium; methyl sulfate IUPAC Name: bis[2-(2-hydroxyethoxy)ethyl]-methyl-octadecylazanium; methyl sulfate Traditional Name: bis[2-(2-hydroxyethoxy)ethyl]-methyl-stearyl-ammonium; methyl sulfate Formula: C28H61NO8S MolecularWeight: 571.85084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CCOCCO)CCOCCO.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(CCOCCO)CCOCCO.COS(=O)(=O)[O-]

InChI

InChI=1S/C27H58NO4.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28(2,20-24-31-26-22-29)21-25-32-27-23-30;1-5-6(2,3)4/h29-30H,3-27H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1