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

Systemtic Name: [1-[3-[4-(dimethylamino)pyridin-1-ium-1-yl]propyl]pyridin-4-ylidene]methyl-oxidanylidene-azanium dibromide Openeye Name: [1-[3-[4-(dimethylamino)pyridin-1-ium-1-yl]propyl]-4-pyridylidene]methyl-oxo-ammonium dibromide CAS Name: [1-[3-[4-(dimethylamino)-1-pyridin-1-iumyl]propyl]-4-pyridinylidene]methyl-oxoammonium dibromide IUPAC Name: [1-[3-[4-(dimethylamino)pyridin-1-ium-1-yl]propyl]pyridin-4-ylidene]methyl-oxoazanium dibromide Traditional Name: [1-[3-[4-(dimethylamino)pyridin-1-ium-1-yl]propyl]-4-pyridylidene]methyl-keto-ammonium dibromide Formula: C16H22Br2N4O MolecularWeight: 446.18008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N4O.2BrH/c1-18(2)16-6-12-20(13-7-16)9-3-8-19-10-4-15(5-11-19)14-17-21;;/h4-7,10-14H,3,8-9H2,1-2H3;2*1H/q+1;;/p-1