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

Systemtic Name: 4-[(3-nitro-2-oxidanyl-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(2-hydroxy-3-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(2-hydroxy-3-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(2-hydroxy-3-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(2-hydroxy-3-nitro-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C16H11N3O5 MolecularWeight: 325.27564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C(=CC=C3)[N+](=O)[O-])O)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C(=CC=C3)[N+](=O)[O-])O)C(=O)N2

InChI

InChI=1S/C16H11N3O5/c20-14-10(5-4-8-13(14)19(23)24)9-12-15(21)17-18(16(12)22)11-6-2-1-3-7-11/h1-9,20H,(H,17,21)