octanoate; tributyl(methyl)azanium

Systemtic Name: octanoate; tributyl(methyl)azanium Openeye Name: octanoate; tributyl(methyl)ammonium CAS Name: octanoate; tributyl(methyl)ammonium IUPAC Name: octanoate; tributyl(methyl)azanium Traditional Name: caprylate; tributyl(methyl)ammonium Formula: C21H45NO2 MolecularWeight: 343.5875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H30N.C8H16O2/c1-5-8-11-14(4,12-9-6-2)13-10-7-3;1-2-3-4-5-6-7-8(9)10/h5-13H2,1-4H3;2-7H2,1H3,(H,9,10)/q+1;/p-1