ethyl 1-prop-2-ynylpyridin-1-ium-4-carboxylate bromide

Systemtic Name: ethyl 1-prop-2-ynylpyridin-1-ium-4-carboxylate bromide Openeye Name: ethyl 1-prop-2-ynylpyridin-1-ium-4-carboxylate bromide CAS Name: 1-prop-2-ynyl-4-pyridin-1-iumcarboxylic acid ethyl ester bromide IUPAC Name: ethyl 1-prop-2-ynylpyridin-1-ium-4-carboxylate bromide Traditional Name: 1-propargylpyridin-1-ium-4-carboxylic acid ethyl ester bromide Formula: C11H12BrNO2 MolecularWeight: 270.12248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12NO2.BrH/c1-3-7-12-8-5-10(6-9-12)11(13)14-4-2;/h1,5-6,8-9H,4,7H2,2H3;1H/q+1;/p-1