hexanoate; methyl(trioctyl)azanium

Systemtic Name: hexanoate; methyl(trioctyl)azanium Openeye Name: hexanoate; methyl(trioctyl)ammonium CAS Name: hexanoate; methyl(trioctyl)ammonium IUPAC Name: hexanoate; methyl(trioctyl)azanium Traditional Name: hexanoate; methyl(trioctyl)ammonium Formula: C31H65NO2 MolecularWeight: 483.8533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H54N.C6H12O2/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/h5-25H2,1-4H3;2-5H2,1H3,(H,7,8)/q+1;/p-1