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

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) octanoate Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) octanoate CAS Name: octanoic acid (3-oxo-1H-isobenzofuran-1-yl) ester IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) octanoate Traditional Name: caprylic acid phthalidyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O4/c1-2-3-4-5-6-11-14(17)19-16-13-10-8-7-9-12(13)15(18)20-16/h7-10,16H,2-6,11H2,1H3