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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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