methyl 1-(bromomethyl)pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 1-(bromomethyl)pyridin-1-ium-3-carboxylate Openeye Name: methyl 1-(bromomethyl)pyridin-1-ium-3-carboxylate CAS Name: 1-(bromomethyl)-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-(bromomethyl)pyridin-1-ium-3-carboxylate Traditional Name: 1-(bromomethyl)pyridin-1-ium-3-carboxylic acid methyl ester Formula: C8H9BrNO2+ MolecularWeight: 231.06656

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C[N+](=CC=C1)CBr

Isomeric SMILES

COC(=O)C1=C[N+](=CC=C1)CBr

InChI

InChI=1S/C8H9BrNO2/c1-12-8(11)7-3-2-4-10(5-7)6-9/h2-5H,6H2,1H3/q+1