(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-1-(1,3,5-trimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(1,3,5-trimethylpyrazol-4-yl)prop-2-en-1-one Formula: C15H14BrFN2O MolecularWeight: 337.186863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C15H14BrFN2O/c1-9-15(10(2)19(3)18-9)14(20)7-4-11-8-12(16)5-6-13(11)17/h4-8H,1-3H3/b7-4+