methyl 1-(2-methoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-carboxylate bromide

Systemtic Name: methyl 1-(2-methoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-carboxylate bromide Openeye Name: methyl 1-(2-methoxy-2-oxo-ethyl)pyridin-1-ium-4-carboxylate bromide CAS Name: 1-(2-methoxy-2-oxoethyl)-4-pyridin-1-iumcarboxylic acid methyl ester bromide IUPAC Name: methyl 1-(2-methoxy-2-oxoethyl)pyridin-1-ium-4-carboxylate bromide Traditional Name: 1-(2-keto-2-methoxy-ethyl)pyridin-1-ium-4-carboxylic acid methyl ester bromide Formula: C10H12BrNO4 MolecularWeight: 290.11058

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[N+]1=CC=C(C=C1)C(=O)OC.[Br-]

Isomeric SMILES

COC(=O)C[N+]1=CC=C(C=C1)C(=O)OC.[Br-]

InChI

InChI=1S/C10H12NO4.BrH/c1-14-9(12)7-11-5-3-8(4-6-11)10(13)15-2;/h3-6H,7H2,1-2H3;1H/q+1;/p-1