2-nitro-N-[1,3,4-tris(oxidanylidene)isoquinolin-6-yl]benzamide

Systemtic Name: 2-nitro-N-[1,3,4-tris(oxidanylidene)isoquinolin-6-yl]benzamide Openeye Name: 2-nitro-N-(1,3,4-trioxo-6-isoquinolyl)benzamide CAS Name: 2-nitro-N-(1,3,4-trioxo-6-isoquinolinyl)benzamide IUPAC Name: 2-nitro-N-(1,3,4-trioxoisoquinolin-6-yl)benzamide Traditional Name: 2-nitro-N-(1,3,4-triketo-6-isoquinolyl)benzamide Formula: C16H9N3O6 MolecularWeight: 339.25916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC(=O)C3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC(=O)C3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H9N3O6/c20-13-11-7-8(5-6-9(11)14(21)18-16(13)23)17-15(22)10-3-1-2-4-12(10)19(24)25/h1-7H,(H,17,22)(H,18,21,23)