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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C(=O)O)OC

InChI

InChI=1S/C12H12O5/c1-16-10-6-4-8(7-11(10)17-2)3-5-9(13)12(14)15/h3-7H,1-2H3,(H,14,15)/b5-3+