1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carbonitrile bromide

Systemtic Name: 1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carbonitrile bromide Openeye Name: 1-[2-(4-chlorophenyl)-2-oxo-ethyl]pyridin-1-ium-3-carbonitrile bromide CAS Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]-3-pyridin-1-iumcarbonitrile bromide IUPAC Name: 1-[2-(4-chlorophenyl)-2-oxoethyl]pyridin-1-ium-3-carbonitrile bromide Traditional Name: 1-[2-(4-chlorophenyl)-2-keto-ethyl]pyridin-1-ium-3-carbonitrile bromide Formula: C14H10BrClN2O MolecularWeight: 337.599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClN2O.BrH/c15-13-5-3-12(4-6-13)14(18)10-17-7-1-2-11(8-16)9-17;/h1-7,9H,10H2;1H/q+1;/p-1