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

Systemtic Name: 4-[(2-nitro-5-oxidanyl-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(5-hydroxy-2-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(5-hydroxy-2-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(5-hydroxy-2-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(5-hydroxy-2-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)O)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

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

InChI

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