ethyl 3-pyridin-1-ium-1-ylpropanoate bromide

Systemtic Name: ethyl 3-pyridin-1-ium-1-ylpropanoate bromide Openeye Name: ethyl 3-pyridin-1-ium-1-ylpropanoate bromide CAS Name: 3-(1-pyridin-1-iumyl)propanoic acid ethyl ester bromide IUPAC Name: ethyl 3-pyridin-1-ium-1-ylpropanoate bromide Traditional Name: 3-pyridin-1-ium-1-ylpropionic acid ethyl ester bromide Formula: C10H14BrNO2 MolecularWeight: 260.12766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14NO2.BrH/c1-2-13-10(12)6-9-11-7-4-3-5-8-11;/h3-5,7-8H,2,6,9H2,1H3;1H/q+1;/p-1