(4Z)-4-[[5-(5-nitro-2-oxidanyl-phenyl)furan-2-yl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4Z)-4-[[5-(5-nitro-2-oxidanyl-phenyl)furan-2-yl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4Z)-4-[[5-(2-hydroxy-5-nitro-phenyl)-2-furyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4Z)-4-[[5-(2-hydroxy-5-nitrophenyl)-2-furanyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4Z)-4-[[5-(2-hydroxy-5-nitrophenyl)furan-2-yl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4Z)-4-[[5-(2-hydroxy-5-nitro-phenyl)-2-furyl]methylene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C20H13N3O6 MolecularWeight: 391.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])O)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])O)/C(=O)N2

InChI

InChI=1S/C20H13N3O6/c24-17-8-6-13(23(27)28)10-15(17)18-9-7-14(29-18)11-16-19(25)21-22(20(16)26)12-4-2-1-3-5-12/h1-11,24H,(H,21,25)/b16-11-