diethyl-di(icosyl)azanium; methyl sulfate

Systemtic Name: diethyl-di(icosyl)azanium; methyl sulfate Openeye Name: diethyl-di(icosyl)ammonium; methyl sulfate CAS Name: di(eicosyl)-diethylammonium; methyl sulfate IUPAC Name: diethyl-di(icosyl)azanium; methyl sulfate Traditional Name: diarachyl(diethyl)ammonium; methyl sulfate Formula: C45H95NO4S MolecularWeight: 746.3051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC[N+](CC)(CC)CCCCCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC[N+](CC)(CC)CCCCCCCCCCCCCCCCCCCC.COS(=O)(=O)[O-]

InChI

InChI=1S/C44H92N.CH4O4S/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45(7-3,8-4)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2;1-5-6(2,3)4/h5-44H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1