(E)-4-(2,3-dimethoxyphenyl)-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-(2,3-dimethoxyphenyl)-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-(2,3-dimethoxyphenyl)-2-oxo-but-3-enoic acid CAS Name: (E)-4-(2,3-dimethoxyphenyl)-2-oxo-3-butenoic acid IUPAC Name: (E)-4-(2,3-dimethoxyphenyl)-2-oxobut-3-enoic acid Traditional Name: (E)-4-(2,3-dimethoxyphenyl)-2-keto-but-3-enoic acid Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=CC(=O)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C/C(=O)C(=O)O

InChI

InChI=1S/C12H12O5/c1-16-10-5-3-4-8(11(10)17-2)6-7-9(13)12(14)15/h3-7H,1-2H3,(H,14,15)/b7-6+