1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]propyl]-N-methyl-pyridin-1-ium-3-carboxamide dibromide

Systemtic Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]propyl]-N-methyl-pyridin-1-ium-3-carboxamide dibromide Openeye Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]propyl]-N-methyl-pyridin-1-ium-3-carboxamide dibromide CAS Name: 1-[3-[3-[(E)-hydroxyiminomethyl]-1-pyridin-1-iumyl]propyl]-N-methyl-3-pyridin-1-iumcarboxamide dibromide IUPAC Name: 1-[3-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]propyl]-N-methylpyridin-1-ium-3-carboxamide dibromide Traditional Name: 1-[3-[3-[(E)-hydroximinomethyl]pyridin-1-ium-1-yl]propyl]-N-methyl-pyridin-1-ium-3-carboxamide dibromide Formula: C16H20Br2N4O2 MolecularWeight: 460.1636

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C[N+](=CC=C1)CCC[N+]2=CC=CC(=C2)C=NO.[Br-].[Br-]

Isomeric SMILES

CNC(=O)C1=C[N+](=CC=C1)CCC[N+]2=CC=CC(=C2)/C=N/O.[Br-].[Br-]

InChI

InChI=1S/C16H18N4O2.2BrH/c1-17-16(21)15-6-3-8-20(13-15)10-4-9-19-7-2-5-14(12-19)11-18-22;;/h2-3,5-8,11-13H,4,9-10H2,1H3;2*1H/b18-11+;;