(2Z)-5-bromanyl-2-[[1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5-bromanyl-2-[[1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[[1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[[1-(4-nitrophenyl)-3-phenyl-4-pyrazolyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[[1-(4-nitrophenyl)-3-phenylpyrazol-4-yl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-bromo-2-[[1-(4-nitrophenyl)-3-phenyl-pyrazol-4-yl]methylene]coumaran-3-one Formula: C24H14BrN3O4 MolecularWeight: 488.28966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H14BrN3O4/c25-17-6-11-21-20(13-17)24(29)22(32-21)12-16-14-27(18-7-9-19(10-8-18)28(30)31)26-23(16)15-4-2-1-3-5-15/h1-14H/b22-12-