1-methylpyridin-1-ium-3-carboxylic acid bromide

Systemtic Name: 1-methylpyridin-1-ium-3-carboxylic acid bromide Openeye Name: 1-methylpyridin-1-ium-3-carboxylic acid bromide CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid bromide IUPAC Name: 1-methylpyridin-1-ium-3-carboxylic acid bromide Traditional Name: 1-methylpyridin-1-ium-3-carboxylic acid bromide Formula: C7H8BrNO2 MolecularWeight: 218.04792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7NO2.BrH/c1-8-4-2-3-6(5-8)7(9)10;/h2-5H,1H3;1H