2-(6-nitroisoquinolin-1-yl)isoindole-1,3-dione

Systemtic Name: 2-(6-nitroisoquinolin-1-yl)isoindole-1,3-dione Openeye Name: 2-(6-nitro-1-isoquinolyl)isoindoline-1,3-dione CAS Name: 2-(6-nitro-1-isoquinolinyl)isoindole-1,3-dione IUPAC Name: 2-(6-nitroisoquinolin-1-yl)isoindole-1,3-dione Traditional Name: 2-(6-nitro-1-isoquinolyl)isoindoline-1,3-quinone Formula: C17H9N3O4 MolecularWeight: 319.27106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=NC=CC4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=NC=CC4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H9N3O4/c21-16-13-3-1-2-4-14(13)17(22)19(16)15-12-6-5-11(20(23)24)9-10(12)7-8-18-15/h1-9H