4-(2,3-dimethoxyphenyl)-2-oxidanylidene-pentanoic acid

Systemtic Name: 4-(2,3-dimethoxyphenyl)-2-oxidanylidene-pentanoic acid Openeye Name: 4-(2,3-dimethoxyphenyl)-2-oxo-pentanoic acid CAS Name: 4-(2,3-dimethoxyphenyl)-2-oxopentanoic acid IUPAC Name: 4-(2,3-dimethoxyphenyl)-2-oxopentanoic acid Traditional Name: 4-(2,3-dimethoxyphenyl)-2-keto-valeric acid Formula: C13H16O5 MolecularWeight: 252.26314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O5/c1-8(7-10(14)13(15)16)9-5-4-6-11(17-2)12(9)18-3/h4-6,8H,7H2,1-3H3,(H,15,16)