2-(4-nitrophenyl)-N-[1,3,4-tris(oxidanylidene)isoquinolin-5-yl]ethanamide

Systemtic Name: 2-(4-nitrophenyl)-N-[1,3,4-tris(oxidanylidene)isoquinolin-5-yl]ethanamide Openeye Name: 2-(4-nitrophenyl)-N-(1,3,4-trioxo-5-isoquinolyl)acetamide CAS Name: 2-(4-nitrophenyl)-N-(1,3,4-trioxo-5-isoquinolinyl)acetamide IUPAC Name: 2-(4-nitrophenyl)-N-(1,3,4-trioxoisoquinolin-5-yl)acetamide Traditional Name: 2-(4-nitrophenyl)-N-(1,3,4-triketo-5-isoquinolyl)acetamide Formula: C17H11N3O6 MolecularWeight: 353.28574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C(=O)NC2=O

InChI

InChI=1S/C17H11N3O6/c21-13(8-9-4-6-10(7-5-9)20(25)26)18-12-3-1-2-11-14(12)15(22)17(24)19-16(11)23/h1-7H,8H2,(H,18,21)(H,19,23,24)