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

Systemtic Name: 4-[(5-chloranyl-3-nitro-2-oxidanyl-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(5-chloro-2-hydroxy-3-nitro-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(5-chloro-2-hydroxy-3-nitrophenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(5-chloro-2-hydroxy-3-nitro-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C16H10ClN3O5 MolecularWeight: 359.7207

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC(=C3O)[N+](=O)[O-])Cl)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC(=C3O)[N+](=O)[O-])Cl)C(=O)N2

InChI

InChI=1S/C16H10ClN3O5/c17-10-6-9(14(21)13(8-10)20(24)25)7-12-15(22)18-19(16(12)23)11-4-2-1-3-5-11/h1-8,21H,(H,18,22)