7-(1,3-benzodioxol-5-yl)-5-(hydroxymethyl)-6-(3-oxidanylprop-1-ynyl)-3H-2-benzofuran-1-one

Systemtic Name: 7-(1,3-benzodioxol-5-yl)-5-(hydroxymethyl)-6-(3-oxidanylprop-1-ynyl)-3H-2-benzofuran-1-one Openeye Name: 7-(1,3-benzodioxol-5-yl)-5-(hydroxymethyl)-6-(3-hydroxyprop-1-ynyl)-3H-isobenzofuran-1-one CAS Name: 7-(1,3-benzodioxol-5-yl)-5-(hydroxymethyl)-6-(3-hydroxyprop-1-ynyl)-3H-isobenzofuran-1-one IUPAC Name: 7-(1,3-benzodioxol-5-yl)-5-(hydroxymethyl)-6-(3-hydroxyprop-1-ynyl)-3H-2-benzofuran-1-one Traditional Name: 7-(1,3-benzodioxol-5-yl)-6-(3-hydroxyprop-1-ynyl)-5-methylol-phthalide Formula: C19H14O6 MolecularWeight: 338.31086

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C(C(=C2C(=O)O1)C3=CC4=C(C=C3)OCO4)C#CCO)CO

Isomeric SMILES

C1C2=CC(=C(C(=C2C(=O)O1)C3=CC4=C(C=C3)OCO4)C#CCO)CO

InChI

InChI=1S/C19H14O6/c20-5-1-2-14-12(8-21)6-13-9-23-19(22)18(13)17(14)11-3-4-15-16(7-11)25-10-24-15/h3-4,6-7,20-21H,5,8-10H2