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

Systemtic Name: (2Z)-5-bromanyl-2-[[3-(4-ethoxy-3-fluoranyl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[[3-(4-ethoxy-3-fluorophenyl)-1-phenyl-4-pyrazolyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[[3-(4-ethoxy-3-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-bromo-2-[[3-(4-ethoxy-3-fluoro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]coumaran-3-one Formula: C26H18BrFN2O3 MolecularWeight: 505.335123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=CC=C5)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=CC=C5)F

InChI

InChI=1S/C26H18BrFN2O3/c1-2-32-23-10-8-16(12-21(23)28)25-17(15-30(29-25)19-6-4-3-5-7-19)13-24-26(31)20-14-18(27)9-11-22(20)33-24/h3-15H,2H2,1H3/b24-13-