4-[[5-bromanyl-2-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[5-bromanyl-2-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[5-bromo-2-[(5-nitro-2-pyridyl)oxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[5-bromo-2-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[5-bromo-2-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[5-bromo-2-[(5-nitro-2-pyridyl)oxy]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C21H13BrN4O5 MolecularWeight: 481.25572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)OC4=NC=C(C=C4)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)Br)OC4=NC=C(C=C4)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C21H13BrN4O5/c22-14-6-8-18(31-19-9-7-16(12-23-19)26(29)30)13(10-14)11-17-20(27)24-25(21(17)28)15-4-2-1-3-5-15/h1-12H,(H,24,27)