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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClN3O5/c17-10-2-1-3-11(8-10)19-16(23)13(15(22)18-19)7-9-6-12(20(24)25)4-5-14(9)21/h1-8,21H,(H,18,22)/b13-7+