2,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-3-carboxylic acid

Systemtic Name: 2,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-3-carboxylic acid Openeye Name: 2,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-3-carboxylic acid CAS Name: 2,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-3-carboxylic acid IUPAC Name: 2,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-3-carboxylic acid Traditional Name: 4-keto-2,6,6-trimethyl-5,7-dihydrobenzofuran-3-carboxylic acid Formula: C12H14O4 MolecularWeight: 222.23716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)CC(CC2=O)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(O1)CC(CC2=O)(C)C)C(=O)O

InChI

InChI=1S/C12H14O4/c1-6-9(11(14)15)10-7(13)4-12(2,3)5-8(10)16-6/h4-5H2,1-3H3,(H,14,15)