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Details

Stereochemistry ACHIRAL
Molecular Formula C15H9ClFNO3
Molecular Weight 305.688
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CARBOXY LUMIRACOXIB LACTAM

SMILES

OC(=O)C1=CC=C2N(C(=O)CC2=C1)C3=C(Cl)C=CC=C3F

InChI

InChIKey=CYWNCAUMMWNHKA-UHFFFAOYSA-N
InChI=1S/C15H9ClFNO3/c16-10-2-1-3-11(17)14(10)18-12-5-4-8(15(20)21)6-9(12)7-13(18)19/h1-6H,7H2,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C15H9ClFNO3
Molecular Weight 305.688
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 16:42:14 UTC 2023
Edited
by admin
on Sat Dec 16 16:42:14 UTC 2023
Record UNII
143TZ5O2NI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CARBOXY LUMIRACOXIB LACTAM
Common Name English
1H-INDOLE-5-CARBOXYLIC ACID, 1-(2-CHLORO-6-FLUOROPHENYL)-2,3-DIHYDRO-2-OXO-
Systematic Name English
LUMIRACOXIB METABOLITE M15
Common Name English
1-(2-CHLORO-6-FLUOROPHENYL)-2,3-DIHYDRO-2-OXO-1H-INDOLE-5-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
697287-13-1
Created by admin on Sat Dec 16 16:42:15 UTC 2023 , Edited by admin on Sat Dec 16 16:42:15 UTC 2023
PRIMARY
FDA UNII
143TZ5O2NI
Created by admin on Sat Dec 16 16:42:15 UTC 2023 , Edited by admin on Sat Dec 16 16:42:15 UTC 2023
PRIMARY
PUBCHEM
154584901
Created by admin on Sat Dec 16 16:42:15 UTC 2023 , Edited by admin on Sat Dec 16 16:42:15 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE
PARENT -> METABOLITE
MINOR
PLASMA