Ketcher 03122415382D 1   1.00000     0.00000     0

 25 26  0     0  0            999 V2000
    8.3841   -7.8373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3841   -8.8373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5180   -7.3373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.2501  -10.3373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3841  -10.8373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8482  -10.8373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8481  -11.8373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7142  -10.3373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5802  -10.8374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  2  4  2  0     0  0
  3  5  1  0     0  0
  4  6  1  0     0  0
  5  6  2  0     0  0
  3  7  1  0     0  0
  7  8  1  0     0  0
  7  9  1  0     0  0
  7 10  1  0     0  0
  2 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 12 14  2  0     0  0
 13 15  2  0     0  0
 14 16  1  0     0  0
 15 17  1  0     0  0
 16 17  2  0     0  0
 14 18  1  0     0  0
 18 19  2  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 18 22  1  0     0  0
 22 23  2  0     0  0
 22 24  1  0     0  0
 24 25  1  0     0  0
M  END
> <ID>
CHEBI:229760

> <NAME>
flupyroxystrobin

> <DEFINITION>
A member of the class of pyridines that is pyridine substituted by 2-[(1E)-1,3-dimethoxy-3-oxoprop-1-en-2-yl]phenoxy and trifluoromethyl groups at positions 2 and 4, respectively. It is an insecticide developed by Syngenta Crop Protection AG.

> <STAR>
3

> <SYNONYM>
SYN549888; SYN 549888; methyl (E)-alpha-(methoxymethylene)-2-[[4-(trifluoromethyl)-2-pyridinyl]oxy]benzeneacetate; methyl (E)-3-methoxy-2-(2-{[4-(trifluoromethyl)-2-pyridyl]oxy}phenyl)acrylate; methyl (2E)-3-methoxy-2-(2-{[4-(trifluoromethyl)-2-pyridyl]oxy}phenyl)propenoate

> <IUPAC_NAME>
methyl (2E)-3-methoxy-2-(2-{[4-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)prop-2-enoate

> <FORMULA>
C17H14F3NO4

> <MASS>
353.297

> <MONOISOTOPIC_MASS>
353.08749

> <CHARGE>
0

> <SMILES>
CO\C=C(\C(=O)OC)C1=C(OC2=NC=CC(=C2)C(F)(F)F)C=CC=C1

> <INCHI>
InChI=1S/C17H14F3NO4/c1-23-10-13(16(22)24-2)12-5-3-4-6-14(12)25-15-9-11(7-8-21-15)17(18,19)20/h3-10H,1-2H3/b13-10+

> <INCHIKEY>
SEEIKOSFZLBRHO-JLHYYAGUSA-N

> <CAS_REGISTRY_NUMBER>
114077-75-7

$$$$