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

Systemtic Name: (2Z)-5-bromanyl-2-[[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-bromo-2-[[3-(4-nitrophenyl)-1-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)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C=C4C(=O)C5=C(O4)C=CC(=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])/C=C\4/C(=O)C5=C(O4)C=CC(=C5)Br

InChI

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