3-[2-oxidanylidene-2-(2-phenoxypyridin-3-yl)ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-oxidanylidene-2-(2-phenoxypyridin-3-yl)ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-oxo-2-(2-phenoxy-3-pyridyl)ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-oxo-2-(2-phenoxy-3-pyridinyl)ethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-oxo-2-(2-phenoxypyridin-3-yl)ethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-keto-2-(2-phenoxy-3-pyridyl)ethyl]phthalide Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)CC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)CC3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H15NO4/c23-18(13-19-15-9-4-5-10-16(15)21(24)26-19)17-11-6-12-22-20(17)25-14-7-2-1-3-8-14/h1-12,19H,13H2