(5-methoxycarbonylfuran-2-yl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: (5-methoxycarbonylfuran-2-yl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: (5-methoxycarbonyl-2-furyl)methyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid (5-methoxycarbonyl-2-furanyl)methyl ester IUPAC Name: (5-methoxycarbonylfuran-2-yl)methyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid (5-carbomethoxy-2-furyl)methyl ester Formula: C13H11NO6 MolecularWeight: 277.22954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C13H11NO6/c1-18-13(16)11-3-2-10(20-11)8-19-12(15)9-4-6-14(17)7-5-9/h2-7H,8H2,1H3