trioctyl(phenyl)azanium bromide

Systemtic Name: trioctyl(phenyl)azanium bromide Openeye Name: trioctyl(phenyl)ammonium bromide CAS Name: trioctyl(phenyl)ammonium bromide IUPAC Name: trioctyl(phenyl)azanium bromide Traditional Name: trioctyl(phenyl)ammonium bromide Formula: C30H56BrN MolecularWeight: 510.67634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)C1=CC=CC=C1.[Br-]

InChI

InChI=1S/C30H56N.BrH/c1-4-7-10-13-16-22-27-31(30-25-20-19-21-26-30,28-23-17-14-11-8-5-2)29-24-18-15-12-9-6-3;/h19-21,25-26H,4-18,22-24,27-29H2,1-3H3;1H/q+1;/p-1