1-[(2E)-2-(3-ethanoyl-1-oxidanylidene-pyridin-1-ium-2-ylidene)-1-oxidanidyl-pyridin-3-yl]ethanone

Systemtic Name: 1-[(2E)-2-(3-ethanoyl-1-oxidanylidene-pyridin-1-ium-2-ylidene)-1-oxidanidyl-pyridin-3-yl]ethanone Openeye Name: 1-[(2E)-2-(3-acetyl-1-oxo-pyridin-1-ium-2-ylidene)-1-oxido-3-pyridyl]ethanone CAS Name: 1-[(2E)-2-(3-acetyl-1-oxo-2-pyridin-1-iumylidene)-1-oxido-3-pyridinyl]ethanone IUPAC Name: 1-[(2E)-2-(3-acetyl-1-oxopyridin-1-ium-2-ylidene)-1-oxidopyridin-3-yl]ethanone Traditional Name: 1-[(2E)-2-(3-acetyl-1-keto-pyridin-1-ium-2-ylidene)-1-oxido-3-pyridyl]ethanone Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O4/c1-9(17)11-5-3-7-15(19)13(11)14-12(10(2)18)6-4-8-16(14)20/h3-8H,1-2H3/b14-13+