(4E)-4-[(4-bromophenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-bromophenyl)methylene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(4-bromophenyl)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one Traditional Name: (4E)-4-(4-bromobenzylidene)-2-(4-nitrophenyl)-5-phenyl-2-pyrazolin-3-one Formula: C22H14BrN3O3 MolecularWeight: 448.26886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=CC3=CC=C(C=C3)Br)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=C/C3=CC=C(C=C3)Br)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14BrN3O3/c23-17-8-6-15(7-9-17)14-20-21(16-4-2-1-3-5-16)24-25(22(20)27)18-10-12-19(13-11-18)26(28)29/h1-14H/b20-14+