U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C19H14ClFN4O4
Molecular Weight 416.79
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-((6-(2-CHLOROPHENOXY)-5-FLUORO-4-PYRIMIDINYL)OXY)-.ALPHA.-(METHOXYIMINO)BENZENEACETAMIDE

SMILES

CO\N=C(\C(N)=O)C1=CC=CC=C1OC2=NC=NC(OC3=CC=CC=C3Cl)=C2F

InChI

InChIKey=DPNOYUYIQDKVTL-PCLIKHOPSA-N
InChI=1S/C19H14ClFN4O4/c1-27-25-16(17(22)26)11-6-2-4-8-13(11)28-18-15(21)19(24-10-23-18)29-14-9-5-3-7-12(14)20/h2-10H,1H3,(H2,22,26)/b25-16+

HIDE SMILES / InChI

Molecular Formula C19H14ClFN4O4
Molecular Weight 416.79
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:07:49 GMT 2023
Edited
by admin
on Sat Dec 16 10:07:49 GMT 2023
Record UNII
V5UXD7C2D2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((6-(2-CHLOROPHENOXY)-5-FLUORO-4-PYRIMIDINYL)OXY)-.ALPHA.-(METHOXYIMINO)BENZENEACETAMIDE
Systematic Name English
BENZENEACETAMIDE, 2-((6-(2-CHLOROPHENOXY)-5-FLUORO-4-PYRIMIDINYL)OXY)-.ALPHA.-(METHOXYIMINO)-, E-
Systematic Name English
BENZENEACETAMIDE, 2-((6-(2-CHLOROPHENOXY)-5-FLUORO-4-PYRIMIDINYL)OXY)-.ALPHA.-(METHOXYIMINO)-
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 628869
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
Code System Code Type Description
PUBCHEM
109374191
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
PRIMARY
CAS
852429-83-5
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
PRIMARY
FDA UNII
V5UXD7C2D2
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
PRIMARY
CAS
207515-50-2
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID70894978
Created by admin on Sat Dec 16 10:07:49 GMT 2023 , Edited by admin on Sat Dec 16 10:07:49 GMT 2023
PRIMARY