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

Systemtic Name: (4E)-4-[(5-bromanyl-3-nitro-2-oxidanyl-phenyl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione Openeye Name: (4E)-4-[(5-bromo-2-hydroxy-3-nitro-phenyl)methylene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione CAS Name: (4E)-4-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione IUPAC Name: (4E)-4-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-1-(4-chlorophenyl)pyrazolidine-3,5-dione Traditional Name: (4E)-4-(5-bromo-2-hydroxy-3-nitro-benzylidene)-1-(4-chlorophenyl)pyrazolidine-3,5-quinone Formula: C16H9BrClN3O5 MolecularWeight: 438.61676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CC3=CC(=CC(=C3O)[N+](=O)[O-])Br)C(=O)N2)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)/C(=C/C3=CC(=CC(=C3O)[N+](=O)[O-])Br)/C(=O)N2)Cl

InChI

InChI=1S/C16H9BrClN3O5/c17-9-5-8(14(22)13(7-9)21(25)26)6-12-15(23)19-20(16(12)24)11-3-1-10(18)2-4-11/h1-7,22H,(H,19,23)/b12-6+