2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide

Systemtic Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide Openeye Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide CAS Name: 2-methyl-2-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide IUPAC Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide Traditional Name: 2-methyl-2-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,3-dihydrobenzo[de]isoquinolin-2-ium dibromide Formula: C21H30Br2N2 MolecularWeight: 470.2843

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CCC[N+]2(CC3=CC=CC4=C3C(=CC=C4)C2)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1(CCCC1)CCC[N+]2(CC3=CC=CC4=C3C(=CC=C4)C2)C.[Br-].[Br-]

InChI

InChI=1S/C21H30N2.2BrH/c1-22(12-3-4-13-22)14-7-15-23(2)16-19-10-5-8-18-9-6-11-20(17-23)21(18)19;;/h5-6,8-11H,3-4,7,12-17H2,1-2H3;2*1H/q+2;;/p-2