methyl 1-methylpyridin-1-ium-4-carboxylate bromide

Systemtic Name: methyl 1-methylpyridin-1-ium-4-carboxylate bromide Openeye Name: methyl 1-methylpyridin-1-ium-4-carboxylate bromide CAS Name: 1-methyl-4-pyridin-1-iumcarboxylic acid methyl ester bromide IUPAC Name: methyl 1-methylpyridin-1-ium-4-carboxylate bromide Traditional Name: 1-methylpyridin-1-ium-4-carboxylic acid methyl ester bromide Formula: C8H10BrNO2 MolecularWeight: 232.0745

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10NO2.BrH/c1-9-5-3-7(4-6-9)8(10)11-2;/h3-6H,1-2H3;1H/q+1;/p-1