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

Systemtic Name: [(2Z)-2-[3-(hydroxymethyl)-1-oxidanidyl-pyridin-2-ylidene]-1-oxidanylidene-pyridin-1-ium-3-yl]methyl ethanoate Openeye Name: [(2Z)-2-[3-(hydroxymethyl)-1-oxido-2-pyridylidene]-1-oxo-pyridin-1-ium-3-yl]methyl acetate CAS Name: acetic acid [(2Z)-2-[3-(hydroxymethyl)-1-oxido-2-pyridinylidene]-1-oxo-3-pyridin-1-iumyl]methyl ester IUPAC Name: [(2Z)-2-[3-(hydroxymethyl)-1-oxidopyridin-2-ylidene]-1-oxopyridin-1-ium-3-yl]methyl acetate Traditional Name: acetic acid [(2Z)-1-keto-2-(3-methylol-1-oxido-2-pyridylidene)pyridin-1-ium-3-yl]methyl ester Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=C[N+](=O)C1=C2C(=CC=CN2[O-])CO

Isomeric SMILES

CC(=O)OCC\1=CC=C[N+](=O)/C1=C\2/C(=CC=CN2[O-])CO

InChI

InChI=1S/C14H14N2O5/c1-10(18)21-9-12-5-3-7-16(20)14(12)13-11(8-17)4-2-6-15(13)19/h2-7,17H,8-9H2,1H3/b14-13-