ethyl 1-methylquinolin-1-ium-4-carboxylate bromide

Systemtic Name: ethyl 1-methylquinolin-1-ium-4-carboxylate bromide Openeye Name: ethyl 1-methylquinolin-1-ium-4-carboxylate bromide CAS Name: 1-methyl-4-quinolin-1-iumcarboxylic acid ethyl ester bromide IUPAC Name: ethyl 1-methylquinolin-1-ium-4-carboxylate bromide Traditional Name: 1-methylquinolin-1-ium-4-carboxylic acid ethyl ester bromide Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=[N+](C2=CC=CC=C12)C.[Br-]

Isomeric SMILES

CCOC(=O)C1=CC=[N+](C2=CC=CC=C12)C.[Br-]

InChI

InChI=1S/C13H14NO2.BrH/c1-3-16-13(15)11-8-9-14(2)12-7-5-4-6-10(11)12;/h4-9H,3H2,1-2H3;1H/q+1;/p-1