U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C9H7Cl2N5O
Molecular Weight 272.091
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LAMOTRIGINE N2-OXIDE

SMILES

NC1=NC(N)=[N+]([O-])N=C1C2=CC=CC(Cl)=C2Cl

InChI

InChIKey=BYLMIGDGWPCFNQ-UHFFFAOYSA-N
InChI=1S/C9H7Cl2N5O/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16(17)15-7/h1-3H,(H4,12,13,14)

HIDE SMILES / InChI

Molecular Formula C9H7Cl2N5O
Molecular Weight 272.091
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 Mon Mar 31 22:46:34 GMT 2025
Edited
by admin
on Mon Mar 31 22:46:34 GMT 2025
Record UNII
38TV183VGM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LAMOTRIGINE N2-OXIDE
Preferred Name English
Code System Code Type Description
CAS
136565-76-9
Created by admin on Mon Mar 31 22:46:34 GMT 2025 , Edited by admin on Mon Mar 31 22:46:34 GMT 2025
PRIMARY
FDA UNII
38TV183VGM
Created by admin on Mon Mar 31 22:46:34 GMT 2025 , Edited by admin on Mon Mar 31 22:46:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID50568044
Created by admin on Mon Mar 31 22:46:34 GMT 2025 , Edited by admin on Mon Mar 31 22:46:34 GMT 2025
PRIMARY
PUBCHEM
15089895
Created by admin on Mon Mar 31 22:46:34 GMT 2025 , Edited by admin on Mon Mar 31 22:46:34 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE