methyl 2-bromanylpyridin-1-ium-3-carboxylate

Systemtic Name: methyl 2-bromanylpyridin-1-ium-3-carboxylate Openeye Name: methyl 2-bromopyridin-1-ium-3-carboxylate CAS Name: 2-bromo-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-bromopyridin-1-ium-3-carboxylate Traditional Name: 2-bromopyridin-1-ium-3-carboxylic acid methyl ester Formula: C7H7BrNO2+ MolecularWeight: 217.03998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C([NH+]=CC=C1)Br

Isomeric SMILES

COC(=O)C1=C([NH+]=CC=C1)Br

InChI

InChI=1S/C7H6BrNO2/c1-11-7(10)5-3-2-4-9-6(5)8/h2-4H,1H3/p+1