1-(1-methylpyridin-1-ium-3-yl)-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: 1-(1-methylpyridin-1-ium-3-yl)-3-oxidanylidene-but-1-en-1-olate Openeye Name: 1-(1-methylpyridin-1-ium-3-yl)-3-oxo-but-1-en-1-olate CAS Name: 1-(1-methyl-3-pyridin-1-iumyl)-3-oxo-1-buten-1-olate IUPAC Name: 1-(1-methylpyridin-1-ium-3-yl)-3-oxobut-1-en-1-olate Traditional Name: 3-keto-1-(1-methylpyridin-1-ium-3-yl)but-1-en-1-olate Formula: C10H11NO2 MolecularWeight: 177.19984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO2/c1-8(12)6-10(13)9-4-3-5-11(2)7-9/h3-7H,1-2H3