methyl 2-methyl-5-[[methyl-(1-oxidanidylpyridin-1-ium-3-yl)carbonyl-amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[methyl-(1-oxidanidylpyridin-1-ium-3-yl)carbonyl-amino]methyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[[methyl-(1-oxidopyridin-1-ium-3-carbonyl)amino]methyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[methyl-[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]amino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[methyl-(1-oxidopyridin-1-ium-3-carbonyl)amino]methyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[methyl-(1-oxidopyridin-1-ium-3-carbonyl)amino]methyl]furan-3-carboxylic acid methyl ester Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)C2=C[N+](=CC=C2)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)C2=C[N+](=CC=C2)[O-])C(=O)OC

InChI

InChI=1S/C15H16N2O5/c1-10-13(15(19)21-3)7-12(22-10)9-16(2)14(18)11-5-4-6-17(20)8-11/h4-8H,9H2,1-3H3