U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H3Cl3N4O4
Molecular Weight 337.504
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-NITRO-5-(2,3,4-TRICHLORO-6-NITROPHENYL)IMIDAZOLE

SMILES

[O-][N+](=O)C1=C(N=CN1)C2=C(C=C(Cl)C(Cl)=C2Cl)[N+]([O-])=O

InChI

InChIKey=NQCCVWLOXJPXOB-UHFFFAOYSA-N
InChI=1S/C9H3Cl3N4O4/c10-3-1-4(15(17)18)5(7(12)6(3)11)8-9(16(19)20)14-2-13-8/h1-2H,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C9H3Cl3N4O4
Molecular Weight 337.504
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 23:08:10 GMT 2025
Edited
by admin
on Mon Mar 31 23:08:10 GMT 2025
Record UNII
43V187N7JV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-NITRO-5-(2,3,4-TRICHLORO-6-NITROPHENYL)IMIDAZOLE
Systematic Name English
1H-IMIDAZOLE, 5-NITRO-4-(2,3,4-TRICHLORO-6-NITROPHENYL)-
Preferred Name English
Code System Code Type Description
PUBCHEM
135565772
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY
CAS
14298-07-8
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY
FDA UNII
43V187N7JV
Created by admin on Mon Mar 31 23:08:10 GMT 2025 , Edited by admin on Mon Mar 31 23:08:10 GMT 2025
PRIMARY