5-(2,3-dihydro-1,4-benzoxazin-4-ylcarbonyl)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione

Systemtic Name: 5-(2,3-dihydro-1,4-benzoxazin-4-ylcarbonyl)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione Openeye Name: 5-(2,3-dihydro-1,4-benzoxazine-4-carbonyl)-2-(3-pyridylmethyl)isoindoline-1,3-dione CAS Name: 5-[2,3-dihydro-1,4-benzoxazin-4-yl(oxo)methyl]-2-(3-pyridinylmethyl)isoindole-1,3-dione IUPAC Name: 5-(2,3-dihydro-1,4-benzoxazine-4-carbonyl)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione Traditional Name: 5-(2,3-dihydro-1,4-benzoxazine-4-carbonyl)-2-(3-pyridylmethyl)isoindoline-1,3-quinone Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N1C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CN=CC=C5

Isomeric SMILES

C1COC2=CC=CC=C2N1C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CN=CC=C5

InChI

InChI=1S/C23H17N3O4/c27-21(25-10-11-30-20-6-2-1-5-19(20)25)16-7-8-17-18(12-16)23(29)26(22(17)28)14-15-4-3-9-24-13-15/h1-9,12-13H,10-11,14H2