5-propan-2-yl-3-pyridin-3-yl-3H-2-benzofuran-1-one

Systemtic Name: 5-propan-2-yl-3-pyridin-3-yl-3H-2-benzofuran-1-one Openeye Name: 5-isopropyl-3-(3-pyridyl)-3H-isobenzofuran-1-one CAS Name: 5-propan-2-yl-3-(3-pyridinyl)-3H-isobenzofuran-1-one IUPAC Name: 5-propan-2-yl-3-pyridin-3-yl-3H-2-benzofuran-1-one Traditional Name: 5-isopropyl-3-(3-pyridyl)phthalide Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C(=O)OC2C3=CN=CC=C3

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)C(=O)OC2C3=CN=CC=C3

InChI

InChI=1S/C16H15NO2/c1-10(2)11-5-6-13-14(8-11)15(19-16(13)18)12-4-3-7-17-9-12/h3-10,15H,1-2H3