trioctyl-(phenylmethyl)azanium

Systemtic Name: trioctyl-(phenylmethyl)azanium Openeye Name: benzyl(trioctyl)ammonium CAS Name: trioctyl-(phenylmethyl)ammonium IUPAC Name: benzyl(trioctyl)azanium Traditional Name: benzyl(trioctyl)ammonium Formula: C31H58N+ MolecularWeight: 444.79892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CC1=CC=CC=C1

InChI

InChI=1S/C31H58N/c1-4-7-10-13-16-22-27-32(28-23-17-14-11-8-5-2,29-24-18-15-12-9-6-3)30-31-25-20-19-21-26-31/h19-21,25-26H,4-18,22-24,27-30H2,1-3H3/q+1