[(2Z)-2-[3-(acetyloxymethyl)-1-oxidanylidene-pyridin-1-ium-2-ylidene]-1-oxidanidyl-pyridin-3-yl]methyl ethanoate

Systemtic Name: [(2Z)-2-[3-(acetyloxymethyl)-1-oxidanylidene-pyridin-1-ium-2-ylidene]-1-oxidanidyl-pyridin-3-yl]methyl ethanoate Openeye Name: [(2Z)-2-[3-(acetoxymethyl)-1-oxo-pyridin-1-ium-2-ylidene]-1-oxido-3-pyridyl]methyl acetate CAS Name: acetic acid [(2Z)-2-[3-(acetyloxymethyl)-1-oxo-2-pyridin-1-iumylidene]-1-oxido-3-pyridinyl]methyl ester IUPAC Name: [(2Z)-2-[3-(acetyloxymethyl)-1-oxopyridin-1-ium-2-ylidene]-1-oxidopyridin-3-yl]methyl acetate Traditional Name: acetic acid [(2Z)-2-[3-(acetoxymethyl)-1-keto-pyridin-1-ium-2-ylidene]-1-oxido-3-pyridyl]methyl ester Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=CN(C1=C2C(=CC=C[N+]2=O)COC(=O)C)[O-]

Isomeric SMILES

CC(=O)OCC\1=CC=CN(/C1=C\2/C(=CC=C[N+]2=O)COC(=O)C)[O-]

InChI

InChI=1S/C16H16N2O6/c1-11(19)23-9-13-5-3-7-17(21)15(13)16-14(10-24-12(2)20)6-4-8-18(16)22/h3-8H,9-10H2,1-2H3/b16-15-