(E)-1-(2,5-dimethoxypyridin-1-ium-1-yl)-2-methyl-3-oxidanyl-prop-2-en-1-one chloride

Systemtic Name: (E)-1-(2,5-dimethoxypyridin-1-ium-1-yl)-2-methyl-3-oxidanyl-prop-2-en-1-one chloride Openeye Name: (E)-1-(2,5-dimethoxypyridin-1-ium-1-yl)-3-hydroxy-2-methyl-prop-2-en-1-one chloride CAS Name: (E)-1-(2,5-dimethoxy-1-pyridin-1-iumyl)-3-hydroxy-2-methyl-2-propen-1-one chloride IUPAC Name: (E)-1-(2,5-dimethoxypyridin-1-ium-1-yl)-3-hydroxy-2-methylprop-2-en-1-one chloride Traditional Name: (E)-1-(2,5-dimethoxypyridin-1-ium-1-yl)-3-hydroxy-2-methyl-prop-2-en-1-one chloride Formula: C11H14ClNO4 MolecularWeight: 259.68616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CO)C(=O)[N+]1=C(C=CC(=C1)OC)OC.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4.ClH/c1-8(7-13)11(14)12-6-9(15-2)4-5-10(12)16-3;/h4-7H,1-3H3;1H