1-dodecylisoquinolin-2-ium; trimethylazanium; bromide; chloride

Systemtic Name: 1-dodecylisoquinolin-2-ium; trimethylazanium; bromide; chloride Openeye Name: 1-dodecylisoquinolin-2-ium; trimethylammonium; bromide; chloride CAS Name: 1-dodecylisoquinolin-2-ium; trimethylammonium; bromide; chloride IUPAC Name: 1-dodecylisoquinolin-2-ium; trimethylazanium; bromide; chloride Traditional Name: 1-laurylisoquinolin-2-ium; trimethylammonium; bromide; chloride Formula: C24H42BrClN2 MolecularWeight: 473.96068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=[NH+]C=CC2=CC=CC=C21.C[NH+](C)C.[Cl-].[Br-]

Isomeric SMILES

CCCCCCCCCCCCC1=[NH+]C=CC2=CC=CC=C21.C[NH+](C)C.[Cl-].[Br-]

InChI

InChI=1S/C21H31N.C3H9N.BrH.ClH/c1-2-3-4-5-6-7-8-9-10-11-16-21-20-15-13-12-14-19(20)17-18-22-21;1-4(2)3;;/h12-15,17-18H,2-11,16H2,1H3;1-3H3;2*1H