decanoate; methyl(trioctyl)azanium

Systemtic Name: decanoate; methyl(trioctyl)azanium Openeye Name: decanoate; methyl(trioctyl)ammonium CAS Name: decanoate; methyl(trioctyl)ammonium IUPAC Name: decanoate; methyl(trioctyl)azanium Traditional Name: caprate; methyl(trioctyl)ammonium Formula: C35H73NO2 MolecularWeight: 539.95962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H54N.C10H20O2/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;1-2-3-4-5-6-7-8-9-10(11)12/h5-25H2,1-4H3;2-9H2,1H3,(H,11,12)/q+1;/p-1