1-propylpyridin-1-ium-4-carbonitrile bromide

Systemtic Name: 1-propylpyridin-1-ium-4-carbonitrile bromide Openeye Name: 1-propylpyridin-1-ium-4-carbonitrile bromide CAS Name: 1-propyl-4-pyridin-1-iumcarbonitrile bromide IUPAC Name: 1-propylpyridin-1-ium-4-carbonitrile bromide Traditional Name: 1-propylpyridin-1-ium-4-carbonitrile bromide Formula: C9H11BrN2 MolecularWeight: 227.10104

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC=C(C=C1)C#N.[Br-]

Isomeric SMILES

CCC[N+]1=CC=C(C=C1)C#N.[Br-]

InChI

InChI=1S/C9H11N2.BrH/c1-2-5-11-6-3-9(8-10)4-7-11;/h3-4,6-7H,2,5H2,1H3;1H/q+1;/p-1