[4-[(E)-[(1-oxidanidylpyridin-1-ium-3-yl)carbonylhydrazinylidene]methyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[(E)-[(1-oxidanidylpyridin-1-ium-3-yl)carbonylhydrazinylidene]methyl]phenyl] furan-2-carboxylate Openeye Name: [4-[(E)-[(1-oxidopyridin-1-ium-3-carbonyl)hydrazono]methyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(E)-[[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(1-oxidopyridin-1-ium-3-carbonyl)hydrazinylidene]methyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(E)-[(1-oxidopyridin-1-ium-3-carbonyl)hydrazono]methyl]phenyl] ester Formula: C18H13N3O5 MolecularWeight: 351.31292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)[O-])C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC(=C[N+](=C1)[O-])C(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C18H13N3O5/c22-17(14-3-1-9-21(24)12-14)20-19-11-13-5-7-15(8-6-13)26-18(23)16-4-2-10-25-16/h1-12H,(H,20,22)/b19-11+