(Z)-2-(3,5-dimethylpyridin-1-ium-1-yl)-1,3-dimethoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-(3,5-dimethylpyridin-1-ium-1-yl)-1,3-dimethoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-2-(3,5-dimethylpyridin-1-ium-1-yl)-1,3-dimethoxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-(3,5-dimethyl-1-pyridin-1-iumyl)-1,3-dimethoxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-2-(3,5-dimethylpyridin-1-ium-1-yl)-1,3-dimethoxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-2-(3,5-dimethylpyridin-1-ium-1-yl)-3-keto-1,3-dimethoxy-prop-1-en-1-olate Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C(=C([O-])OC)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C[N+](=C1)/C(=C(/[O-])\OC)/C(=O)OC)C

InChI

InChI=1S/C12H15NO4/c1-8-5-9(2)7-13(6-8)10(11(14)16-3)12(15)17-4/h5-7H,1-4H3