2-[(3,4-dimethoxyphenyl)methyl]propanedioic acid

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]propanedioic acid Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]propanedioic acid CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]propanedioic acid IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]propanedioic acid Traditional Name: 2-veratrylmalonic acid Formula: C12H14O6 MolecularWeight: 254.23596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O6/c1-17-9-4-3-7(6-10(9)18-2)5-8(11(13)14)12(15)16/h3-4,6,8H,5H2,1-2H3,(H,13,14)(H,15,16)