methyl(tripentyl)azanium; octanoate

Systemtic Name: methyl(tripentyl)azanium; octanoate Openeye Name: methyl(tripentyl)ammonium; octanoate CAS Name: methyl(tripentyl)ammonium; octanoate IUPAC Name: methyl(tripentyl)azanium; octanoate Traditional Name: caprylate; triamyl(methyl)ammonium Formula: C24H51NO2 MolecularWeight: 385.66724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H36N.C8H16O2/c1-5-8-11-14-17(4,15-12-9-6-2)16-13-10-7-3;1-2-3-4-5-6-7-8(9)10/h5-16H2,1-4H3;2-7H2,1H3,(H,9,10)/q+1;/p-1