7-methoxy-3-(1-oxidanylbutyl)-3H-2-benzofuran-1-one

Systemtic Name: 7-methoxy-3-(1-oxidanylbutyl)-3H-2-benzofuran-1-one Openeye Name: 3-(1-hydroxybutyl)-7-methoxy-3H-isobenzofuran-1-one CAS Name: 3-(1-hydroxybutyl)-7-methoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(1-hydroxybutyl)-7-methoxy-3H-2-benzofuran-1-one Traditional Name: 3-(1-hydroxybutyl)-7-methoxy-phthalide Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1C2=C(C(=CC=C2)OC)C(=O)O1)O

Isomeric SMILES

CCCC(C1C2=C(C(=CC=C2)OC)C(=O)O1)O

InChI

InChI=1S/C13H16O4/c1-3-5-9(14)12-8-6-4-7-10(16-2)11(8)13(15)17-12/h4,6-7,9,12,14H,3,5H2,1-2H3