1-[2-(2-nitrophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carbonitrile bromide

Systemtic Name: 1-[2-(2-nitrophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-carbonitrile bromide Openeye Name: 1-[2-(2-nitrophenyl)-2-oxo-ethyl]pyridin-1-ium-4-carbonitrile bromide CAS Name: 1-[2-(2-nitrophenyl)-2-oxoethyl]-4-pyridin-1-iumcarbonitrile bromide IUPAC Name: 1-[2-(2-nitrophenyl)-2-oxoethyl]pyridin-1-ium-4-carbonitrile bromide Traditional Name: 1-[2-keto-2-(2-nitrophenyl)ethyl]pyridin-1-ium-4-carbonitrile bromide Formula: C14H10BrN3O3 MolecularWeight: 348.1515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N3O3.BrH/c15-9-11-5-7-16(8-6-11)10-14(18)12-3-1-2-4-13(12)17(19)20;/h1-8H,10H2;1H/q+1;/p-1