(2Z)-5-bromanyl-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5-bromanyl-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5-bromo-2-[(1,3-diphenylpyrazol-4-yl)methylene]benzofuran-3-one CAS Name: (2Z)-5-bromo-2-[(1,3-diphenyl-4-pyrazolyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-5-bromo-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5-bromo-2-[(1,3-diphenylpyrazol-4-yl)methylene]coumaran-3-one Formula: C24H15BrN2O2 MolecularWeight: 443.2921

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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=CC=C5

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=CC=C5

InChI

InChI=1S/C24H15BrN2O2/c25-18-11-12-21-20(14-18)24(28)22(29-21)13-17-15-27(19-9-5-2-6-10-19)26-23(17)16-7-3-1-4-8-16/h1-15H/b22-13-