dimethyl-octyl-(phenylmethyl)azanium ethanoate

Systemtic Name: dimethyl-octyl-(phenylmethyl)azanium ethanoate Openeye Name: benzyl-dimethyl-octyl-ammonium acetate CAS Name: dimethyl-octyl-(phenylmethyl)ammonium acetate IUPAC Name: benzyl-dimethyl-octylazanium acetate Traditional Name: benzyl-dimethyl-octyl-ammonium acetate Formula: C19H33NO2 MolecularWeight: 307.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CC(=O)[O-]

Isomeric SMILES

CCCCCCCC[N+](C)(C)CC1=CC=CC=C1.CC(=O)[O-]

InChI

InChI=1S/C17H30N.C2H4O2/c1-4-5-6-7-8-12-15-18(2,3)16-17-13-10-9-11-14-17;1-2(3)4/h9-11,13-14H,4-8,12,15-16H2,1-3H3;1H3,(H,3,4)/q+1;/p-1