ethyl 2-(3-bromanylpyridin-1-ium-1-yl)ethanoate bromide

Systemtic Name: ethyl 2-(3-bromanylpyridin-1-ium-1-yl)ethanoate bromide Openeye Name: ethyl 2-(3-bromopyridin-1-ium-1-yl)acetate bromide CAS Name: 2-(3-bromo-1-pyridin-1-iumyl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(3-bromopyridin-1-ium-1-yl)acetate bromide Traditional Name: 2-(3-bromopyridin-1-ium-1-yl)acetic acid ethyl ester bromide Formula: C9H11Br2NO2 MolecularWeight: 324.99714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11BrNO2.BrH/c1-2-13-9(12)7-11-5-3-4-8(10)6-11;/h3-6H,2,7H2,1H3;1H/q+1;/p-1