3-methyl-2-[3-(3-methylisoquinolin-2-ium-2-yl)propyl]isoquinolin-2-ium bromide

Systemtic Name: 3-methyl-2-[3-(3-methylisoquinolin-2-ium-2-yl)propyl]isoquinolin-2-ium bromide Openeye Name: 3-methyl-2-[3-(3-methylisoquinolin-2-ium-2-yl)propyl]isoquinolin-2-ium bromide CAS Name: 3-methyl-2-[3-(3-methyl-2-isoquinolin-2-iumyl)propyl]isoquinolin-2-ium bromide IUPAC Name: 3-methyl-2-[3-(3-methylisoquinolin-2-ium-2-yl)propyl]isoquinolin-2-ium bromide Traditional Name: 3-methyl-2-[3-(3-methylisoquinolin-2-ium-2-yl)propyl]isoquinolin-2-ium bromide Formula: C23H24BrN2+ MolecularWeight: 408.35406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C=[N+]1CCC[N+]3=CC4=CC=CC=C4C=C3C.[Br-]

Isomeric SMILES

CC1=CC2=CC=CC=C2C=[N+]1CCC[N+]3=CC4=CC=CC=C4C=C3C.[Br-]

InChI

InChI=1S/C23H24N2.BrH/c1-18-14-20-8-3-5-10-22(20)16-24(18)12-7-13-25-17-23-11-6-4-9-21(23)15-19(25)2;/h3-6,8-11,14-17H,7,12-13H2,1-2H3;1H/q+2;/p-1