methyl 2-(2-methylpyridin-1-ium-1-yl)ethanoate bromide

Systemtic Name: methyl 2-(2-methylpyridin-1-ium-1-yl)ethanoate bromide Openeye Name: methyl 2-(2-methylpyridin-1-ium-1-yl)acetate bromide CAS Name: 2-(2-methyl-1-pyridin-1-iumyl)acetic acid methyl ester bromide IUPAC Name: methyl 2-(2-methylpyridin-1-ium-1-yl)acetate bromide Traditional Name: 2-(2-methylpyridin-1-ium-1-yl)acetic acid methyl ester bromide Formula: C9H12BrNO2 MolecularWeight: 246.10108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)OC.[Br-]

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)OC.[Br-]

InChI

InChI=1S/C9H12NO2.BrH/c1-8-5-3-4-6-10(8)7-9(11)12-2;/h3-6H,7H2,1-2H3;1H/q+1;/p-1