(1Z)-1-cyano-4-ethoxycarbonyloxy-1-pyridin-1-ium-1-yl-penta-1,4-dien-2-olate

Systemtic Name: (1Z)-1-cyano-4-ethoxycarbonyloxy-1-pyridin-1-ium-1-yl-penta-1,4-dien-2-olate Openeye Name: (1Z)-1-cyano-4-ethoxycarbonyloxy-1-pyridin-1-ium-1-yl-penta-1,4-dien-2-olate CAS Name: (1Z)-1-cyano-4-ethoxycarbonyloxy-1-(1-pyridin-1-iumyl)-2-penta-1,4-dienolate IUPAC Name: (1Z)-1-cyano-4-ethoxycarbonyloxy-1-pyridin-1-ium-1-ylpenta-1,4-dien-2-olate Traditional Name: (1Z)-4-carbethoxyoxy-1-cyano-1-pyridin-1-ium-1-yl-penta-1,4-dien-2-olate Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=C)CC(=C(C#N)[N+]1=CC=CC=C1)[O-]

Isomeric SMILES

CCOC(=O)OC(=C)C/C(=C(\C#N)/[N+]1=CC=CC=C1)/[O-]

InChI

InChI=1S/C14H14N2O4/c1-3-19-14(18)20-11(2)9-13(17)12(10-15)16-7-5-4-6-8-16/h4-8H,2-3,9H2,1H3/b13-12-