(3-oxidanylidene-1H-2-benzofuran-1-yl) pentanoate

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) pentanoate Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) pentanoate CAS Name: pentanoic acid (3-oxo-1H-isobenzofuran-1-yl) ester IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) pentanoate Traditional Name: valeric acid phthalidyl ester Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1C2=CC=CC=C2C(=O)O1

Isomeric SMILES

CCCCC(=O)OC1C2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C13H14O4/c1-2-3-8-11(14)16-13-10-7-5-4-6-9(10)12(15)17-13/h4-7,13H,2-3,8H2,1H3