6-(3-phenylpropoxy)-3H-2-benzofuran-1-one

Systemtic Name: 6-(3-phenylpropoxy)-3H-2-benzofuran-1-one Openeye Name: 6-(3-phenylpropoxy)-3H-isobenzofuran-1-one CAS Name: 6-(3-phenylpropoxy)-3H-isobenzofuran-1-one IUPAC Name: 6-(3-phenylpropoxy)-3H-2-benzofuran-1-one Traditional Name: 6-(3-phenylpropoxy)phthalide Formula: C17H16O3 MolecularWeight: 268.30714

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)OCCCC3=CC=CC=C3)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)OCCCC3=CC=CC=C3)C(=O)O1

InChI

InChI=1S/C17H16O3/c18-17-16-11-15(9-8-14(16)12-20-17)19-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11H,4,7,10,12H2