3-(2-methyl-3-oxidanylidene-butan-2-yl)-3H-2-benzofuran-1-one

Systemtic Name: 3-(2-methyl-3-oxidanylidene-butan-2-yl)-3H-2-benzofuran-1-one Openeye Name: 3-(1,1-dimethyl-2-oxo-propyl)-3H-isobenzofuran-1-one CAS Name: 3-(2-methyl-3-oxobutan-2-yl)-3H-isobenzofuran-1-one IUPAC Name: 3-(2-methyl-3-oxobutan-2-yl)-3H-2-benzofuran-1-one Traditional Name: 3-(2-keto-1,1-dimethyl-propyl)phthalide Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)C1C2=CC=CC=C2C(=O)O1

Isomeric SMILES

CC(=O)C(C)(C)C1C2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C13H14O3/c1-8(14)13(2,3)11-9-6-4-5-7-10(9)12(15)16-11/h4-7,11H,1-3H3