methyl 6-(diacetyloxymethyl)-1-oxidanidyl-pyridin-1-ium-3-carboxylate

Systemtic Name: methyl 6-(diacetyloxymethyl)-1-oxidanidyl-pyridin-1-ium-3-carboxylate Openeye Name: methyl 6-(diacetoxymethyl)-1-oxido-pyridin-1-ium-3-carboxylate CAS Name: 6-(diacetyloxymethyl)-1-oxido-3-pyridin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 6-(diacetyloxymethyl)-1-oxidopyridin-1-ium-3-carboxylate Traditional Name: 6-(diacetoxymethyl)-1-oxido-pyridin-1-ium-3-carboxylic acid methyl ester Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=[N+](C=C(C=C1)C(=O)OC)[O-])OC(=O)C

Isomeric SMILES

CC(=O)OC(C1=[N+](C=C(C=C1)C(=O)OC)[O-])OC(=O)C

InChI

InChI=1S/C12H13NO7/c1-7(14)19-12(20-8(2)15)10-5-4-9(6-13(10)17)11(16)18-3/h4-6,12H,1-3H3