(4E)-2-(4-bromophenyl)-5-methyl-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxyphenyl)methylene]-2-(4-bromophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[(4-phenylmethoxyphenyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(4-bromophenyl)-5-methyl-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one Traditional Name: (4E)-4-(4-benzoxybenzylidene)-2-(4-bromophenyl)-5-methyl-2-pyrazolin-3-one Formula: C24H19BrN2O2 MolecularWeight: 447.32386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H19BrN2O2/c1-17-23(24(28)27(26-17)21-11-9-20(25)10-12-21)15-18-7-13-22(14-8-18)29-16-19-5-3-2-4-6-19/h2-15H,16H2,1H3/b23-15+