5-(3-oxidanylpyridin-1-ium-1-yl)pentanenitrile bromide

Systemtic Name: 5-(3-oxidanylpyridin-1-ium-1-yl)pentanenitrile bromide Openeye Name: 5-(3-hydroxypyridin-1-ium-1-yl)pentanenitrile bromide CAS Name: 5-(3-hydroxy-1-pyridin-1-iumyl)pentanenitrile bromide IUPAC Name: 5-(3-hydroxypyridin-1-ium-1-yl)pentanenitrile bromide Traditional Name: 5-(3-hydroxypyridin-1-ium-1-yl)valeronitrile bromide Formula: C10H13BrN2O MolecularWeight: 257.12702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O.BrH/c11-6-2-1-3-7-12-8-4-5-10(13)9-12;/h4-5,8-9H,1-3,7H2;1H