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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12N4O6/c23-17-13(9-11-5-1-3-7-15(11)21(25)26)19-18(24)14(20-17)10-12-6-2-4-8-16(12)22(27)28/h1-10H,(H,19,24)(H,20,23)/b13-9+,14-10+