3-(4-methyl-2-oxidanylidene-pent-3-enyl)-3H-2-benzofuran-1-one

Systemtic Name: 3-(4-methyl-2-oxidanylidene-pent-3-enyl)-3H-2-benzofuran-1-one Openeye Name: 3-(4-methyl-2-oxo-pent-3-enyl)-3H-isobenzofuran-1-one CAS Name: 3-(4-methyl-2-oxopent-3-enyl)-3H-isobenzofuran-1-one IUPAC Name: 3-(4-methyl-2-oxopent-3-enyl)-3H-2-benzofuran-1-one Traditional Name: 3-(2-keto-4-methyl-pent-3-enyl)phthalide Formula: C14H14O3 MolecularWeight: 230.25916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)CC1C2=CC=CC=C2C(=O)O1)C

Isomeric SMILES

CC(=CC(=O)CC1C2=CC=CC=C2C(=O)O1)C

InChI

InChI=1S/C14H14O3/c1-9(2)7-10(15)8-13-11-5-3-4-6-12(11)14(16)17-13/h3-7,13H,8H2,1-2H3