5-(4-oxidanylidene-3,1-benzoxazin-2-yl)-2-pyridin-4-yl-isoindole-1,3-dione

Systemtic Name: 5-(4-oxidanylidene-3,1-benzoxazin-2-yl)-2-pyridin-4-yl-isoindole-1,3-dione Openeye Name: 5-(4-oxo-3,1-benzoxazin-2-yl)-2-(4-pyridyl)isoindoline-1,3-dione CAS Name: 5-(4-oxo-3,1-benzoxazin-2-yl)-2-pyridin-4-ylisoindole-1,3-dione IUPAC Name: 5-(4-oxo-3,1-benzoxazin-2-yl)-2-pyridin-4-ylisoindole-1,3-dione Traditional Name: 5-(4-keto-3,1-benzoxazin-2-yl)-2-(4-pyridyl)isoindoline-1,3-quinone Formula: C21H11N3O4 MolecularWeight: 369.32974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=NC=C5

InChI

InChI=1S/C21H11N3O4/c25-19-14-6-5-12(18-23-17-4-2-1-3-15(17)21(27)28-18)11-16(14)20(26)24(19)13-7-9-22-10-8-13/h1-11H