(2E)-2-[(3,4-dimethoxyphenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: (2E)-2-[(3,4-dimethoxyphenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: (2E)-2-[(3,4-dimethoxyphenyl)methylene]-3-oxo-butanoate CAS Name: (2E)-2-[(3,4-dimethoxyphenyl)methylidene]-3-oxobutanoate IUPAC Name: (2E)-2-[(3,4-dimethoxyphenyl)methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-(3,4-dimethoxyphenyl)acrylate Formula: C13H13O5- MolecularWeight: 249.23932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O5/c1-8(14)10(13(15)16)6-9-4-5-11(17-2)12(7-9)18-3/h4-7H,1-3H3,(H,15,16)/p-1/b10-6+