(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-4-ethoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-4-ethoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-ethoxy-3-(4-hydroxy-3,5-dimethoxy-phenyl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-ethoxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-ethoxy-3-(4-hydroxy-3,5-dimethoxy-phenyl)-4-keto-but-2-enoic acid Formula: C14H16O7 MolecularWeight: 296.27264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC(=O)O)C1=CC(=C(C(=C1)OC)O)OC

Isomeric SMILES

CCOC(=O)/C(=C/C(=O)O)/C1=CC(=C(C(=C1)OC)O)OC

InChI

InChI=1S/C14H16O7/c1-4-21-14(18)9(7-12(15)16)8-5-10(19-2)13(17)11(6-8)20-3/h5-7,17H,4H2,1-3H3,(H,15,16)/b9-7+