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Details

Stereochemistry ACHIRAL
Molecular Formula C15H13ClFNO3
Molecular Weight 309.72
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXYMETHYL LUMIRACOXIB

SMILES

OCC1=CC=C(NC2=C(Cl)C=CC=C2F)C(CC(O)=O)=C1

InChI

InChIKey=PREBINJQDJNORC-UHFFFAOYSA-N
InChI=1S/C15H13ClFNO3/c16-11-2-1-3-12(17)15(11)18-13-5-4-9(8-19)6-10(13)7-14(20)21/h1-6,18-19H,7-8H2,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C15H13ClFNO3
Molecular Weight 309.72
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 15:46:24 UTC 2023
Edited
by admin
on Sat Dec 16 15:46:24 UTC 2023
Record UNII
BWY4M9ECD7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXYMETHYL LUMIRACOXIB
Common Name English
BENZENEACETIC ACID, 2-((2-CHLORO-6-FLUOROPHENYL)AMINO)-5-(HYDROXYMETHYL)-
Systematic Name English
LUMIRACOXIB METABOLITE M21
Systematic Name English
Code System Code Type Description
CAS
697287-16-4
Created by admin on Sat Dec 16 15:46:24 UTC 2023 , Edited by admin on Sat Dec 16 15:46:24 UTC 2023
PRIMARY
FDA UNII
BWY4M9ECD7
Created by admin on Sat Dec 16 15:46:24 UTC 2023 , Edited by admin on Sat Dec 16 15:46:24 UTC 2023
PRIMARY
PUBCHEM
154585067
Created by admin on Sat Dec 16 15:46:24 UTC 2023 , Edited by admin on Sat Dec 16 15:46:24 UTC 2023
PRIMARY
Related Record Type Details
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