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

Systemtic Name: 2-(5-chloranylpyridin-2-yl)-5-(4-oxidanylidene-3,1-benzoxazin-2-yl)isoindole-1,3-dione Openeye Name: 2-(5-chloro-2-pyridyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindoline-1,3-dione CAS Name: 2-(5-chloro-2-pyridinyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione IUPAC Name: 2-(5-chloropyridin-2-yl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione Traditional Name: 2-(5-chloro-2-pyridyl)-5-(4-keto-3,1-benzoxazin-2-yl)isoindoline-1,3-quinone Formula: C21H10ClN3O4 MolecularWeight: 403.7748

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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=NC=C(C=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H10ClN3O4/c22-12-6-8-17(23-10-12)25-19(26)13-7-5-11(9-15(13)20(25)27)18-24-16-4-2-1-3-14(16)21(28)29-18/h1-10H