5-(2-methylbut-3-yn-2-yloxy)-7-oxidanyl-3H-2-benzofuran-1-one

Systemtic Name: 5-(2-methylbut-3-yn-2-yloxy)-7-oxidanyl-3H-2-benzofuran-1-one Openeye Name: 5-(1,1-dimethylprop-2-ynoxy)-7-hydroxy-3H-isobenzofuran-1-one CAS Name: 7-hydroxy-5-(2-methylbut-3-yn-2-yloxy)-3H-isobenzofuran-1-one IUPAC Name: 7-hydroxy-5-(2-methylbut-3-yn-2-yloxy)-3H-2-benzofuran-1-one Traditional Name: 5-(1,1-dimethylprop-2-ynoxy)-7-hydroxy-phthalide Formula: C13H12O4 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)OC1=CC(=C2C(=C1)COC2=O)O

Isomeric SMILES

CC(C)(C#C)OC1=CC(=C2C(=C1)COC2=O)O

InChI

InChI=1S/C13H12O4/c1-4-13(2,3)17-9-5-8-7-16-12(15)11(8)10(14)6-9/h1,5-6,14H,7H2,2-3H3