2-[2,4-bis(bromanyl)phenoxy]-1-[3-(5-nitrofuran-2-yl)-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-[2,4-bis(bromanyl)phenoxy]-1-[3-(5-nitrofuran-2-yl)-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(2,4-dibromophenoxy)-1-[5-hydroxy-3-(5-nitro-2-furyl)-5-phenyl-4H-pyrazol-1-yl]ethanone CAS Name: 2-(2,4-dibromophenoxy)-1-[5-hydroxy-3-(5-nitro-2-furanyl)-5-phenyl-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(2,4-dibromophenoxy)-1-[5-hydroxy-3-(5-nitrofuran-2-yl)-5-phenyl-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(2,4-dibromophenoxy)-1-[5-hydroxy-3-(5-nitro-2-furyl)-5-phenyl-2-pyrazolin-1-yl]ethanone Formula: C21H15Br2N3O6 MolecularWeight: 565.1683

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1(C2=CC=CC=C2)O)C(=O)COC3=C(C=C(C=C3)Br)Br)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1C(=NN(C1(C2=CC=CC=C2)O)C(=O)COC3=C(C=C(C=C3)Br)Br)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H15Br2N3O6/c22-14-6-7-17(15(23)10-14)31-12-19(27)25-21(28,13-4-2-1-3-5-13)11-16(24-25)18-8-9-20(32-18)26(29)30/h1-10,28H,11-12H2