[1-[3-(3-methylimidazol-3-ium-1-yl)propyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium dibromide

Systemtic Name: [1-[3-(3-methylimidazol-3-ium-1-yl)propyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium dibromide Openeye Name: [1-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-pyridylidene]methyl-oxo-ammonium dibromide CAS Name: [1-[3-(3-methyl-1-imidazol-3-iumyl)propyl]-4-pyridinylidene]methyl-oxoammonium dibromide IUPAC Name: [1-[3-(3-methylimidazol-3-ium-1-yl)propyl]pyridin-4-ylidene]methyl-oxoazanium dibromide Traditional Name: keto-[[1-[3-(3-methylimidazol-3-ium-1-yl)propyl]-4-pyridylidene]methyl]ammonium dibromide Formula: C13H18Br2N4O MolecularWeight: 406.11622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CCCN2C=CC(=C[NH+]=O)C=C2.[Br-].[Br-]

Isomeric SMILES

C[N+]1=CN(C=C1)CCCN2C=CC(=C[NH+]=O)C=C2.[Br-].[Br-]

InChI

InChI=1S/C13H17N4O.2BrH/c1-15-9-10-17(12-15)6-2-5-16-7-3-13(4-8-16)11-14-18;;/h3-4,7-12H,2,5-6H2,1H3;2*1H/q+1;;/p-1