ethyl 2-bromanyl-3-pyridin-1-ium-1-yl-propanoate

Systemtic Name: ethyl 2-bromanyl-3-pyridin-1-ium-1-yl-propanoate Openeye Name: ethyl 2-bromo-3-pyridin-1-ium-1-yl-propanoate CAS Name: 2-bromo-3-(1-pyridin-1-iumyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-bromo-3-pyridin-1-ium-1-ylpropanoate Traditional Name: 2-bromo-3-pyridin-1-ium-1-yl-propionic acid ethyl ester Formula: C10H13BrNO2+ MolecularWeight: 259.11972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13BrNO2/c1-2-14-10(13)9(11)8-12-6-4-3-5-7-12/h3-7,9H,2,8H2,1H3/q+1