ethyl (2Z)-2-(4-ethoxycarbonyl-1-oxidanylidene-pyridin-1-ium-2-ylidene)-1-oxidanidyl-pyridine-4-carboxylate

Systemtic Name: ethyl (2Z)-2-(4-ethoxycarbonyl-1-oxidanylidene-pyridin-1-ium-2-ylidene)-1-oxidanidyl-pyridine-4-carboxylate Openeye Name: ethyl (2Z)-2-(4-ethoxycarbonyl-1-oxo-pyridin-1-ium-2-ylidene)-1-oxido-pyridine-4-carboxylate CAS Name: (2Z)-2-(4-ethoxycarbonyl-1-oxo-2-pyridin-1-iumylidene)-1-oxido-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-2-(4-ethoxycarbonyl-1-oxopyridin-1-ium-2-ylidene)-1-oxidopyridine-4-carboxylate Traditional Name: (2Z)-2-(4-carbethoxy-1-keto-pyridin-1-ium-2-ylidene)-1-oxido-isonicotinic acid ethyl ester Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C=C(C=C[N+]2=O)C(=O)OCC)N(C=C1)[O-]

Isomeric SMILES

CCOC(=O)C1=C/C(=C/2\C=C(C=C[N+]2=O)C(=O)OCC)/N(C=C1)[O-]

InChI

InChI=1S/C16H16N2O6/c1-3-23-15(19)11-5-7-17(21)13(9-11)14-10-12(6-8-18(14)22)16(20)24-4-2/h5-10H,3-4H2,1-2H3/b14-13-