Marvin  08240715302D          

 30 32  0  0  0  0            999 V2000
   -1.0171    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3027    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4118    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1263    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8408    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1263    1.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8408    0.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5552    1.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5552    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2697    2.5125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9842    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6986    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9842    1.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6986    0.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4131    1.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4131    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1441    1.3855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7316    2.1000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.3191    1.3855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4461    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1605    3.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8750    2.5125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1605    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4461    3.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8750    3.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5895    3.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3039    2.5125    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0184    3.7500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3039    3.3375    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -6.0184    2.9250    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
 18  1  1  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  4  2  0  0  0  0
  4  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 11  2  0  0  0  0
 11 13  1  0  0  0  0
 12 16  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 18 20  1  0  0  0  0
 18 17  1  0  0  0  0
 18 19  1  0  0  0  0
 23 20  2  0  0  0  0
 20 24  1  0  0  0  0
 21 25  1  0  0  0  0
 21 24  2  0  0  0  0
 25 22  2  0  0  0  0
 22 23  1  0  0  0  0
 25 26  1  0  0  0  0
 26 29  1  0  0  0  0
 29 27  1  0  0  0  0
 29 28  1  0  0  0  0
 29 30  1  0  0  0  0
M  END
> <ID>
CHEBI:39368

> <NAME>
halfenprox

> <DEFINITION>
An aromatic ether the is the 3-phenoxybenzyl ether of 2-(4-difluorobromomethoxyphenyl)-2-methylpropanol.

> <STAR>
3

> <SYNONYM>
fubfenprox; 3-phenoxybenzyl 2-(4-difluorobromomethoxyphenyl)-2-methylpropyl ether; 2-(4-difluorobromomethoxyphenyl)-2-methylpropyl 3-phenoxybenzyl ether

> <IUPAC_NAME>
1-[(2-{4-[bromo(difluoro)methoxy]phenyl}-2-methylpropoxy)methyl]-3-phenoxybenzene

> <FORMULA>
C24H23BrF2O3

> <MASS>
477.33843

> <MONOISOTOPIC_MASS>
476.07986

> <CHARGE>
0

> <SMILES>
CC(C)(COCc1cccc(Oc2ccccc2)c1)c1ccc(OC(F)(F)Br)cc1

> <INCHI>
InChI=1S/C24H23BrF2O3/c1-23(2,19-11-13-21(14-12-19)30-24(25,26)27)17-28-16-18-7-6-10-22(15-18)29-20-8-4-3-5-9-20/h3-15H,16-17H2,1-2H3

> <INCHIKEY>
WIFXJBMOTMKRMM-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
111872-58-3

> <REAXYS_REGISTRY_NUMBER>
11404200

> <CHEMIDPLUS>
111872-58-3

$$$$