5,6-dimethoxy-3-oxidanylidene-1,2-dihydroindene-1-carboxylic acid

Systemtic Name: 5,6-dimethoxy-3-oxidanylidene-1,2-dihydroindene-1-carboxylic acid Openeye Name: 5,6-dimethoxy-3-oxo-indane-1-carboxylic acid CAS Name: 5,6-dimethoxy-3-oxo-1,2-dihydroindene-1-carboxylic acid IUPAC Name: 5,6-dimethoxy-3-oxo-1,2-dihydroindene-1-carboxylic acid Traditional Name: 3-keto-5,6-dimethoxy-indane-1-carboxylic acid Formula: C12H12O5 MolecularWeight: 236.22068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=O)CC(C2=C1)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=O)CC(C2=C1)C(=O)O)OC

InChI

InChI=1S/C12H12O5/c1-16-10-4-6-7(5-11(10)17-2)9(13)3-8(6)12(14)15/h4-5,8H,3H2,1-2H3,(H,14,15)