(3E,6E)-3,6-bis[(3-nitrophenyl)methylidene]piperazine-2,5-dione

Systemtic Name: (3E,6E)-3,6-bis[(3-nitrophenyl)methylidene]piperazine-2,5-dione Openeye Name: (3E,6E)-3,6-bis[(3-nitrophenyl)methylene]piperazine-2,5-dione CAS Name: (3E,6E)-3,6-bis[(3-nitrophenyl)methylidene]piperazine-2,5-dione IUPAC Name: (3E,6E)-3,6-bis[(3-nitrophenyl)methylidene]piperazine-2,5-dione Traditional Name: (3E,6E)-3,6-bis(3-nitrobenzylidene)piperazine-2,5-quinone Formula: C18H12N4O6 MolecularWeight: 380.31108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C\2/NC(=O)/C(=C\C3=CC(=CC=C3)[N+](=O)[O-])/NC2=O

InChI

InChI=1S/C18H12N4O6/c23-17-15(9-11-3-1-5-13(7-11)21(25)26)19-18(24)16(20-17)10-12-4-2-6-14(8-12)22(27)28/h1-10H,(H,19,24)(H,20,23)/b15-9+,16-10+