ethyl 1-(2-bromanylprop-2-enyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylate bromide

Systemtic Name: ethyl 1-(2-bromanylprop-2-enyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylate bromide Openeye Name: ethyl 1-(2-bromoallyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylate bromide CAS Name: 1-(2-bromoprop-2-enyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylic acid ethyl ester bromide IUPAC Name: ethyl 1-(2-bromoprop-2-enyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylate bromide Traditional Name: 1-(2-bromoallyl)-1-methyl-3,6-dihydro-2H-pyridin-1-ium-4-carboxylic acid ethyl ester bromide Formula: C12H19Br2NO2 MolecularWeight: 369.09276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC[N+](CC1)(C)CC(=C)Br.[Br-]

Isomeric SMILES

CCOC(=O)C1=CC[N+](CC1)(C)CC(=C)Br.[Br-]

InChI

InChI=1S/C12H19BrNO2.BrH/c1-4-16-12(15)11-5-7-14(3,8-6-11)9-10(2)13;/h5H,2,4,6-9H2,1,3H3;1H/q+1;/p-1