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

Systemtic Name: 4-[[3-bromanyl-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-bromo-4-[(5-nitro-2-pyridyl)oxy]phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-bromo-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-bromo-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-bromo-4-[(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=CC(=C(C=C3)OC4=NC=C(C=C4)[N+](=O)[O-])Br)C(=O)N2

Isomeric SMILES

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

InChI

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