3-tert-butyl-3-oxidanyl-2-benzofuran-1-one ethanoate

Systemtic Name: 3-tert-butyl-3-oxidanyl-2-benzofuran-1-one ethanoate Openeye Name: 3-tert-butyl-3-hydroxy-isobenzofuran-1-one acetate CAS Name: 3-tert-butyl-3-hydroxy-1-isobenzofuranone acetate IUPAC Name: 3-tert-butyl-3-hydroxy-2-benzofuran-1-one acetate Traditional Name: 3-tert-butyl-3-hydroxy-phthalide acetate Formula: C14H17O5- MolecularWeight: 265.28178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(C)(C)C1(C2=CC=CC=C2C(=O)O1)O

Isomeric SMILES

CC(=O)[O-].CC(C)(C)C1(C2=CC=CC=C2C(=O)O1)O

InChI

InChI=1S/C12H14O3.C2H4O2/c1-11(2,3)12(14)9-7-5-4-6-8(9)10(13)15-12;1-2(3)4/h4-7,14H,1-3H3;1H3,(H,3,4)/p-1