diethyl 2-(1-oxidanidyl-1,5-naphthyridin-1-ium-4-yl)propanedioate

Systemtic Name: diethyl 2-(1-oxidanidyl-1,5-naphthyridin-1-ium-4-yl)propanedioate Openeye Name: diethyl 2-(1-oxido-1,5-naphthyridin-1-ium-4-yl)propanedioate CAS Name: 2-(1-oxido-1,5-naphthyridin-1-ium-4-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1-oxido-1,5-naphthyridin-1-ium-4-yl)propanedioate Traditional Name: 2-(1-oxido-1,5-naphthyridin-1-ium-4-yl)malonic acid diethyl ester Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C2C(=[N+](C=C1)[O-])C=CC=N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C2C(=[N+](C=C1)[O-])C=CC=N2)C(=O)OCC

InChI

InChI=1S/C15H16N2O5/c1-3-21-14(18)12(15(19)22-4-2)10-7-9-17(20)11-6-5-8-16-13(10)11/h5-9,12H,3-4H2,1-2H3