pyrrolidin-1-yl-[1-[[4-[(3-pyrrolidin-1-ylcarbonylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-3-yl]methanone dibromide

Systemtic Name: pyrrolidin-1-yl-[1-[[4-[(3-pyrrolidin-1-ylcarbonylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium-3-yl]methanone dibromide Openeye Name: [1-[[4-[[3-(pyrrolidine-1-carbonyl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-3-yl]-pyrrolidin-1-yl-methanone dibromide CAS Name: [1-[[4-[[3-[oxo(1-pyrrolidinyl)methyl]-1-pyridin-1-iumyl]methyl]phenyl]methyl]-3-pyridin-1-iumyl]-(1-pyrrolidinyl)methanone dibromide IUPAC Name: [1-[[4-[[3-(pyrrolidine-1-carbonyl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-3-yl]-pyrrolidin-1-ylmethanone dibromide Traditional Name: [1-[4-[[3-(pyrrolidine-1-carbonyl)pyridin-1-ium-1-yl]methyl]benzyl]pyridin-1-ium-3-yl]-pyrrolidino-methanone dibromide Formula: C28H32Br2N4O2 MolecularWeight: 616.38728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C[N+](=CC=C2)CC3=CC=C(C=C3)C[N+]4=CC=CC(=C4)C(=O)N5CCCC5.[Br-].[Br-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=C[N+](=CC=C2)CC3=CC=C(C=C3)C[N+]4=CC=CC(=C4)C(=O)N5CCCC5.[Br-].[Br-]

InChI

InChI=1S/C28H32N4O2.2BrH/c33-27(31-15-1-2-16-31)25-7-5-13-29(21-25)19-23-9-11-24(12-10-23)20-30-14-6-8-26(22-30)28(34)32-17-3-4-18-32;;/h5-14,21-22H,1-4,15-20H2;2*1H/q+2;;/p-2