dimethyl(dioctadecyl)azanium ethanoate

Systemtic Name: dimethyl(dioctadecyl)azanium ethanoate Openeye Name: dimethyl(dioctadecyl)ammonium acetate CAS Name: dimethyl(dioctadecyl)ammonium acetate IUPAC Name: dimethyl(dioctadecyl)azanium acetate Traditional Name: dimethyl(distearyl)ammonium acetate Formula: C40H83NO2 MolecularWeight: 610.09252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H80N.C2H4O2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-2(3)4/h5-38H2,1-4H3;1H3,(H,3,4)/q+1;/p-1