3-(pyridin-4-ylmethylamino)-3H-2-benzofuran-1-one

Systemtic Name: 3-(pyridin-4-ylmethylamino)-3H-2-benzofuran-1-one Openeye Name: 3-(4-pyridylmethylamino)-3H-isobenzofuran-1-one CAS Name: 3-(pyridin-4-ylmethylamino)-3H-isobenzofuran-1-one IUPAC Name: 3-(pyridin-4-ylmethylamino)-3H-2-benzofuran-1-one Traditional Name: 3-(4-pyridylmethylamino)phthalide Formula: C14H12N2O2 MolecularWeight: 240.25728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)NCC3=CC=NC=C3

InChI

InChI=1S/C14H12N2O2/c17-14-12-4-2-1-3-11(12)13(18-14)16-9-10-5-7-15-8-6-10/h1-8,13,16H,9H2