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Details

Stereochemistry ACHIRAL
Molecular Formula C14H19N3O2
Molecular Weight 261.3196
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(1-ETHYLPROPYL)-5,6-DIMETHYL-7-NITRO-1H-BENZIMIDAZOLE

SMILES

CCC(CC)N1C=NC2=C1C(=C(C)C(C)=C2)[N+]([O-])=O

InChI

InChIKey=PXECYAIQPVLQQT-UHFFFAOYSA-N
InChI=1S/C14H19N3O2/c1-5-11(6-2)16-8-15-12-7-9(3)10(4)13(14(12)16)17(18)19/h7-8,11H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C14H19N3O2
Molecular Weight 261.3196
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 21:57:35 GMT 2025
Edited
by admin
on Mon Mar 31 21:57:35 GMT 2025
Record UNII
YY4DOC4P28
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(1-ETHYLPROPYL)-5,6-DIMETHYL-7-NITRO-1H-BENZIMIDAZOLE
Systematic Name English
1H-BENZIMIDAZOLE, 1-(1-ETHYLPROPYL)-5,6-DIMETHYL-7-NITRO-
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID30223462
Created by admin on Mon Mar 31 21:57:35 GMT 2025 , Edited by admin on Mon Mar 31 21:57:35 GMT 2025
PRIMARY
CAS
73215-11-9
Created by admin on Mon Mar 31 21:57:35 GMT 2025 , Edited by admin on Mon Mar 31 21:57:35 GMT 2025
PRIMARY
PUBCHEM
155969
Created by admin on Mon Mar 31 21:57:35 GMT 2025 , Edited by admin on Mon Mar 31 21:57:35 GMT 2025
PRIMARY
FDA UNII
YY4DOC4P28
Created by admin on Mon Mar 31 21:57:35 GMT 2025 , Edited by admin on Mon Mar 31 21:57:35 GMT 2025
PRIMARY