(3E,6E)-3-[(4-nitrophenyl)methylidene]-6-(pyridin-2-ylmethylidene)piperazine-2,5-dione

Systemtic Name: (3E,6E)-3-[(4-nitrophenyl)methylidene]-6-(pyridin-2-ylmethylidene)piperazine-2,5-dione Openeye Name: (3E,6E)-3-[(4-nitrophenyl)methylene]-6-(2-pyridylmethylene)piperazine-2,5-dione CAS Name: (3E,6E)-3-[(4-nitrophenyl)methylidene]-6-(2-pyridinylmethylidene)piperazine-2,5-dione IUPAC Name: (3E,6E)-3-[(4-nitrophenyl)methylidene]-6-(pyridin-2-ylmethylidene)piperazine-2,5-dione Traditional Name: (3E,6E)-3-(4-nitrobenzylidene)-6-(2-pyridylmethylene)piperazine-2,5-quinone Formula: C17H12N4O4 MolecularWeight: 336.30158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=C2C(=O)NC(=CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC=NC(=C1)/C=C/2\C(=O)N/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)N2

InChI

InChI=1S/C17H12N4O4/c22-16-14(9-11-4-6-13(7-5-11)21(24)25)19-17(23)15(20-16)10-12-3-1-2-8-18-12/h1-10H,(H,19,23)(H,20,22)/b14-9+,15-10+