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

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-1-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-1-(1,3-dimethyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)-1-(1,3-dimethylpyrazol-4-yl)prop-2-en-1-one Formula: C14H12BrFN2O MolecularWeight: 323.160283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)C=CC2=C(C=CC(=C2)Br)F)C

Isomeric SMILES

CC1=NN(C=C1C(=O)/C=C/C2=C(C=CC(=C2)Br)F)C

InChI

InChI=1S/C14H12BrFN2O/c1-9-12(8-18(2)17-9)14(19)6-3-10-7-11(15)4-5-13(10)16/h3-8H,1-2H3/b6-3+