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Details

Stereochemistry ACHIRAL
Molecular Formula C23H19Cl2NO4
Molecular Weight 444.307
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACECLOFENAC BENZYL ESTER

SMILES

ClC1=CC=CC(Cl)=C1NC2=CC=CC=C2CC(=O)OCC(=O)OCC3=CC=CC=C3

InChI

InChIKey=RLKZSYGBKCIRFJ-UHFFFAOYSA-N
InChI=1S/C23H19Cl2NO4/c24-18-10-6-11-19(25)23(18)26-20-12-5-4-9-17(20)13-21(27)30-15-22(28)29-14-16-7-2-1-3-8-16/h1-12,26H,13-15H2

HIDE SMILES / InChI

Molecular Formula C23H19Cl2NO4
Molecular Weight 444.307
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 Sat Dec 16 14:55:41 UTC 2023
Edited
by admin
on Sat Dec 16 14:55:41 UTC 2023
Record UNII
7T7ZHK6MQP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACECLOFENAC BENZYL ESTER
Common Name English
ACECLOFENAC IMPURITY F [EP IMPURITY]
Common Name English
BENZYL (((2-((2,6-DICHLOROPHENYL)AMINO)PHENYL)ACETYL)OXY)ACETATE
Systematic Name English
BENZENEACETIC ACID, 2-((2,6-DICHLOROPHENYL)AMINO)-, 2-OXO-2-(PHENYLMETHOXY)ETHYL ESTER
Systematic Name English
BENZYL ESTER OF ACECLOFENAC
Common Name English
Code System Code Type Description
FDA UNII
7T7ZHK6MQP
Created by admin on Sat Dec 16 14:55:41 UTC 2023 , Edited by admin on Sat Dec 16 14:55:41 UTC 2023
PRIMARY
CAS
100499-89-6
Created by admin on Sat Dec 16 14:55:41 UTC 2023 , Edited by admin on Sat Dec 16 14:55:41 UTC 2023
PRIMARY
PUBCHEM
46783543
Created by admin on Sat Dec 16 14:55:41 UTC 2023 , Edited by admin on Sat Dec 16 14:55:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID80676222
Created by admin on Sat Dec 16 14:55:41 UTC 2023 , Edited by admin on Sat Dec 16 14:55:41 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP