methyl 2-(acetyloxymethyl)-1-oxidanidyl-pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 2-(acetyloxymethyl)-1-oxidanidyl-pyridin-1-ium-3-carboxylate Openeye Name: methyl 2-(acetoxymethyl)-1-oxido-pyridin-1-ium-3-carboxylate CAS Name: 2-(acetyloxymethyl)-1-oxido-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 2-(acetyloxymethyl)-1-oxidopyridin-1-ium-3-carboxylate Traditional Name: 2-(acetoxymethyl)-1-oxido-pyridin-1-ium-3-carboxylic acid methyl ester Formula: C10H11NO5 MolecularWeight: 225.19804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C=CC=[N+]1[O-])C(=O)OC

Isomeric SMILES

CC(=O)OCC1=C(C=CC=[N+]1[O-])C(=O)OC

InChI

InChI=1S/C10H11NO5/c1-7(12)16-6-9-8(10(13)15-2)4-3-5-11(9)14/h3-5H,6H2,1-2H3