ethyl-hexadecyl-dimethyl-azanium; ethyl sulfate

Systemtic Name: ethyl-hexadecyl-dimethyl-azanium; ethyl sulfate Openeye Name: ethyl-hexadecyl-dimethyl-ammonium; ethyl sulfate CAS Name: ethyl-hexadecyl-dimethylammonium; ethyl sulfate IUPAC Name: ethyl-hexadecyl-dimethylazanium; ethyl sulfate Traditional Name: cetyl-ethyl-dimethyl-ammonium; ethyl sulfate Formula: C22H49NO4S MolecularWeight: 423.69376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C20H44N.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;1-2-6-7(3,4)5/h5-20H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1