dimethyl-(2-octadecoxy-2-oxidanylidene-ethyl)-octadecyl-azanium chloride

Systemtic Name: dimethyl-(2-octadecoxy-2-oxidanylidene-ethyl)-octadecyl-azanium chloride Openeye Name: dimethyl-(2-octadecoxy-2-oxo-ethyl)-octadecyl-ammonium chloride CAS Name: dimethyl-(2-octadecoxy-2-oxoethyl)-octadecylammonium chloride IUPAC Name: dimethyl-(2-octadecoxy-2-oxoethyl)-octadecylazanium chloride Traditional Name: (2-keto-2-stearyloxy-ethyl)-dimethyl-stearyl-ammonium chloride Formula: C40H82ClNO2 MolecularWeight: 644.53758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)OCCCCCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)OCCCCCCCCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C40H82NO2.ClH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-41(3,4)39-40(42)43-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-39H2,1-4H3;1H/q+1;/p-1