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Details

Stereochemistry ACHIRAL
Molecular Formula C11H8N6O
Molecular Weight 240.2208
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of R-831

SMILES

O=C(NC1=NN=NN1)C2=C3N=CC=CC3=CC=C2

InChI

InChIKey=VSMCHFPJPJNCEE-UHFFFAOYSA-N
InChI=1S/C11H8N6O/c18-10(13-11-14-16-17-15-11)8-5-1-3-7-4-2-6-12-9(7)8/h1-6H,(H2,13,14,15,16,17,18)

HIDE SMILES / InChI

Molecular Formula C11H8N6O
Molecular Weight 240.2208
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 17:55:11 GMT 2025
Edited
by admin
on Mon Mar 31 17:55:11 GMT 2025
Record UNII
J7VQ8II1EY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
R-831
Code English
8-QUINOLINECARBOXAMIDE, N-2H-TETRAZOL-5-YL-
Preferred Name English
N-2H-TETRAZOL-5-YL-8-QUINOLINECARBOXAMIDE
Systematic Name English
Code System Code Type Description
CAS
68056-49-5
Created by admin on Mon Mar 31 17:55:11 GMT 2025 , Edited by admin on Mon Mar 31 17:55:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID10701930
Created by admin on Mon Mar 31 17:55:11 GMT 2025 , Edited by admin on Mon Mar 31 17:55:11 GMT 2025
PRIMARY
PUBCHEM
13192305
Created by admin on Mon Mar 31 17:55:11 GMT 2025 , Edited by admin on Mon Mar 31 17:55:11 GMT 2025
PRIMARY
FDA UNII
J7VQ8II1EY
Created by admin on Mon Mar 31 17:55:11 GMT 2025 , Edited by admin on Mon Mar 31 17:55:11 GMT 2025
PRIMARY