(4-methoxycarbonylphenyl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid (4-carbomethoxybenzyl) ester Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO5/c1-20-14(17)12-4-2-11(3-5-12)10-21-15(18)13-6-8-16(19)9-7-13/h2-9H,10H2,1H3