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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H12BrClF3NO2
Molecular Weight 434.635
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-Benzoyl-4-chlorophenyl)-2-bromo-N-(2,2,2-trifluoroethyl)acetamide

SMILES

FC(F)(F)CN(C(=O)CBr)C1=CC=C(Cl)C=C1C(=O)C2=CC=CC=C2

InChI

InChIKey=YOHLFPANLAUXOX-UHFFFAOYSA-N
InChI=1S/C17H12BrClF3NO2/c18-9-15(24)23(10-17(20,21)22)14-7-6-12(19)8-13(14)16(25)11-4-2-1-3-5-11/h1-8H,9-10H2

HIDE SMILES / InChI

Molecular Formula C17H12BrClF3NO2
Molecular Weight 434.635
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 18:49:01 GMT 2025
Edited
by admin
on Tue Apr 01 18:49:01 GMT 2025
Record UNII
6T3NH8T7U8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Acetamide, N-(2-benzoyl-4-chlorophenyl)-2-bromo-N-(2,2,2-trifluoroethyl)-
Preferred Name English
N-(2-Benzoyl-4-chlorophenyl)-2-bromo-N-(2,2,2-trifluoroethyl)acetamide
Systematic Name English
Code System Code Type Description
CAS
22753-81-7
Created by admin on Tue Apr 01 18:49:01 GMT 2025 , Edited by admin on Tue Apr 01 18:49:01 GMT 2025
PRIMARY
FDA UNII
6T3NH8T7U8
Created by admin on Tue Apr 01 18:49:01 GMT 2025 , Edited by admin on Tue Apr 01 18:49:01 GMT 2025
PRIMARY
ECHA (EC/EINECS)
245-200-0
Created by admin on Tue Apr 01 18:49:01 GMT 2025 , Edited by admin on Tue Apr 01 18:49:01 GMT 2025
PRIMARY
PUBCHEM
89822
Created by admin on Tue Apr 01 18:49:01 GMT 2025 , Edited by admin on Tue Apr 01 18:49:01 GMT 2025
PRIMARY
EPA CompTox
DTXSID00177302
Created by admin on Tue Apr 01 18:49:01 GMT 2025 , Edited by admin on Tue Apr 01 18:49:01 GMT 2025
PRIMARY