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

Systemtic Name: (4E)-4-[[5-bromanyl-2-[(3-fluorophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[5-bromo-2-[(3-fluorophenyl)methoxy]phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[5-bromo-2-[(3-fluorophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[5-bromo-2-[(3-fluorophenyl)methoxy]phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[5-bromo-2-(3-fluorobenzyl)oxy-benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C24H18BrFN2O2 MolecularWeight: 465.314323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H18BrFN2O2/c1-16-22(24(29)28(27-16)21-8-3-2-4-9-21)14-18-13-19(25)10-11-23(18)30-15-17-6-5-7-20(26)12-17/h2-14H,15H2,1H3/b22-14+