dimethyl(dioctadecyl)azanium; propanoate

Systemtic Name: dimethyl(dioctadecyl)azanium; propanoate Openeye Name: dimethyl(dioctadecyl)ammonium; propanoate CAS Name: dimethyl(dioctadecyl)ammonium; propanoate IUPAC Name: dimethyl(dioctadecyl)azanium; propanoate Traditional Name: dimethyl(distearyl)ammonium; propionate Formula: C41H85NO2 MolecularWeight: 624.1191

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H80N.C3H6O2/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)5/h5-38H2,1-4H3;2H2,1H3,(H,4,5)/q+1;/p-1