6-isoquinolin-2-ium-2-ylhexyl(trimethyl)azanium dibromide

Systemtic Name: 6-isoquinolin-2-ium-2-ylhexyl(trimethyl)azanium dibromide Openeye Name: 6-isoquinolin-2-ium-2-ylhexyl(trimethyl)ammonium dibromide CAS Name: 6-(2-isoquinolin-2-iumyl)hexyl-trimethylammonium dibromide IUPAC Name: 6-isoquinolin-2-ium-2-ylhexyl(trimethyl)azanium dibromide Traditional Name: 6-isoquinolin-2-ium-2-ylhexyl(trimethyl)ammonium dibromide Formula: C18H28Br2N2 MolecularWeight: 432.23632

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCCC[N+]1=CC2=CC=CC=C2C=C1.[Br-].[Br-]

Isomeric SMILES

C[N+](C)(C)CCCCCC[N+]1=CC2=CC=CC=C2C=C1.[Br-].[Br-]

InChI

InChI=1S/C18H28N2.2BrH/c1-20(2,3)15-9-5-4-8-13-19-14-12-17-10-6-7-11-18(17)16-19;;/h6-7,10-12,14,16H,4-5,8-9,13,15H2,1-3H3;2*1H/q+2;;/p-2