methyl(trioctyl)azanium; propanoate

Systemtic Name: methyl(trioctyl)azanium; propanoate Openeye Name: methyl(trioctyl)ammonium; propanoate CAS Name: methyl(trioctyl)ammonium; propanoate IUPAC Name: methyl(trioctyl)azanium; propanoate Traditional Name: methyl(trioctyl)ammonium; propionate Formula: C28H59NO2 MolecularWeight: 441.77356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H54N.C3H6O2/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;1-2-3(4)5/h5-25H2,1-4H3;2H2,1H3,(H,4,5)/q+1;/p-1