(4E)-2-(4-fluorophenyl)-4-[(3-methoxy-4-phenylmethoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: (4E)-2-(4-fluorophenyl)-4-[(3-methoxy-4-phenylmethoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxy-3-methoxy-phenyl)methylene]-2-(4-fluorophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(4-fluorophenyl)-4-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(4-fluorophenyl)-4-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-4-(4-benzoxy-3-methoxy-benzylidene)-2-(4-fluorophenyl)-5-methyl-2-pyrazolin-3-one Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21FN2O3/c1-17-22(25(29)28(27-17)21-11-9-20(26)10-12-21)14-19-8-13-23(24(15-19)30-2)31-16-18-6-4-3-5-7-18/h3-15H,16H2,1-2H3/b22-14+