butanoate; triheptyl(methyl)azanium

Systemtic Name: butanoate; triheptyl(methyl)azanium Openeye Name: butanoate; triheptyl(methyl)ammonium CAS Name: butanoate; triheptyl(methyl)ammonium IUPAC Name: butanoate; triheptyl(methyl)azanium Traditional Name: butyrate; triheptyl(methyl)ammonium Formula: C26H55NO2 MolecularWeight: 413.7204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H48N.C4H8O2/c1-5-8-11-14-17-20-23(4,21-18-15-12-9-6-2)22-19-16-13-10-7-3;1-2-3-4(5)6/h5-22H2,1-4H3;2-3H2,1H3,(H,5,6)/q+1;/p-1