5-pyrrol-1-yl-3H-2-benzofuran-1-one

Systemtic Name: 5-pyrrol-1-yl-3H-2-benzofuran-1-one Openeye Name: 5-pyrrol-1-yl-3H-isobenzofuran-1-one CAS Name: 5-(1-pyrrolyl)-3H-isobenzofuran-1-one IUPAC Name: 5-pyrrol-1-yl-3H-2-benzofuran-1-one Traditional Name: 5-pyrrol-1-ylphthalide Formula: C12H9NO2 MolecularWeight: 199.20536

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)N3C=CC=C3)C(=O)O1

Isomeric SMILES

C1C2=C(C=CC(=C2)N3C=CC=C3)C(=O)O1

InChI

InChI=1S/C12H9NO2/c14-12-11-4-3-10(7-9(11)8-15-12)13-5-1-2-6-13/h1-7H,8H2