(3S)-3-butyl-4-oxidanyl-3H-2-benzofuran-1-one

Systemtic Name: (3S)-3-butyl-4-oxidanyl-3H-2-benzofuran-1-one Openeye Name: (3S)-3-butyl-4-hydroxy-3H-isobenzofuran-1-one CAS Name: (3S)-3-butyl-4-hydroxy-3H-isobenzofuran-1-one IUPAC Name: (3S)-3-butyl-4-hydroxy-3H-2-benzofuran-1-one Traditional Name: (3S)-3-butyl-4-hydroxy-phthalide Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=C(C=CC=C2O)C(=O)O1

Isomeric SMILES

CCCC[C@H]1C2=C(C=CC=C2O)C(=O)O1

InChI

InChI=1S/C12H14O3/c1-2-3-7-10-11-8(12(14)15-10)5-4-6-9(11)13/h4-6,10,13H,2-3,7H2,1H3/t10-/m0/s1