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

Systemtic Name: 6-(3-phenoxypropoxy)-3H-2-benzofuran-1-one Openeye Name: 6-(3-phenoxypropoxy)-3H-isobenzofuran-1-one CAS Name: 6-(3-phenoxypropoxy)-3H-isobenzofuran-1-one IUPAC Name: 6-(3-phenoxypropoxy)-3H-2-benzofuran-1-one Traditional Name: 6-(3-phenoxypropoxy)phthalide Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)OCCCOC3=CC=CC=C3)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)OCCCOC3=CC=CC=C3)C(=O)O1

InChI

InChI=1S/C17H16O4/c18-17-16-11-15(8-7-13(16)12-21-17)20-10-4-9-19-14-5-2-1-3-6-14/h1-3,5-8,11H,4,9-10,12H2