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

Systemtic Name: 3-(4-chlorophenyl)-3-(pyridin-3-ylmethylamino)-2-benzofuran-1-one Openeye Name: 3-(4-chlorophenyl)-3-(3-pyridylmethylamino)isobenzofuran-1-one CAS Name: 3-(4-chlorophenyl)-3-(3-pyridinylmethylamino)-1-isobenzofuranone IUPAC Name: 3-(4-chlorophenyl)-3-(pyridin-3-ylmethylamino)-2-benzofuran-1-one Traditional Name: 3-(4-chlorophenyl)-3-(3-pyridylmethylamino)phthalide Formula: C20H15ClN2O2 MolecularWeight: 350.7983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)Cl)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)Cl)NCC4=CN=CC=C4

InChI

InChI=1S/C20H15ClN2O2/c21-16-9-7-15(8-10-16)20(23-13-14-4-3-11-22-12-14)18-6-2-1-5-17(18)19(24)25-20/h1-12,23H,13H2