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

Systemtic Name: ethyl 2-(3-cyanopyridin-1-ium-1-yl)ethanoate bromide Openeye Name: ethyl 2-(3-cyanopyridin-1-ium-1-yl)acetate bromide CAS Name: 2-(3-cyano-1-pyridin-1-iumyl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(3-cyanopyridin-1-ium-1-yl)acetate bromide Traditional Name: 2-(3-cyanopyridin-1-ium-1-yl)acetic acid ethyl ester bromide Formula: C10H11BrN2O2 MolecularWeight: 271.11054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N2O2.BrH/c1-2-14-10(13)8-12-5-3-4-9(6-11)7-12;/h3-5,7H,2,8H2,1H3;1H/q+1;/p-1