3-(4-pyridin-2-ylpyridin-1-ium-1-yl)propylazanium dibromide

Systemtic Name: 3-(4-pyridin-2-ylpyridin-1-ium-1-yl)propylazanium dibromide Openeye Name: 3-[4-(2-pyridyl)pyridin-1-ium-1-yl]propylammonium dibromide CAS Name: 3-[4-(2-pyridinyl)-1-pyridin-1-iumyl]propylammonium dibromide IUPAC Name: 3-(4-pyridin-2-ylpyridin-1-ium-1-yl)propylazanium dibromide Traditional Name: 3-[4-(2-pyridyl)pyridin-1-ium-1-yl]propylammonium dibromide Formula: C13H17Br2N3 MolecularWeight: 375.10218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=[N+](C=C2)CCC[NH3+].[Br-].[Br-]

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=[N+](C=C2)CCC[NH3+].[Br-].[Br-]

InChI

InChI=1S/C13H16N3.2BrH/c14-7-3-9-16-10-5-12(6-11-16)13-4-1-2-8-15-13;;/h1-2,4-6,8,10-11H,3,7,9,14H2;2*1H/q+1;;/p-1