(2,5-dimethoxyphenyl)methyl 1-oxidanidylpyridin-1-ium-2-carboxylate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 1-oxidanidylpyridin-1-ium-2-carboxylate Openeye Name: (2,5-dimethoxyphenyl)methyl 1-oxidopyridin-1-ium-2-carboxylate CAS Name: 1-oxido-2-pyridin-1-iumcarboxylic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 1-oxidopyridin-1-ium-2-carboxylate Traditional Name: 1-oxidopyridin-1-ium-2-carboxylic acid (2,5-dimethoxybenzyl) ester Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C15H15NO5/c1-19-12-6-7-14(20-2)11(9-12)10-21-15(17)13-5-3-4-8-16(13)18/h3-9H,10H2,1-2H3