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Details

Stereochemistry ACHIRAL
Molecular Formula C21H26N4O3
Molecular Weight 382.4561
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DESETHYLISOTONITAZENE

SMILES

CCNCCN1C(CC2=CC=C(OC(C)C)C=C2)=NC3=C1C=CC(=C3)[N+]([O-])=O

InChI

InChIKey=HHBRZWRJZICFRP-UHFFFAOYSA-N
InChI=1S/C21H26N4O3/c1-4-22-11-12-24-20-10-7-17(25(26)27)14-19(20)23-21(24)13-16-5-8-18(9-6-16)28-15(2)3/h5-10,14-15,22H,4,11-13H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C21H26N4O3
Molecular Weight 382.4561
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 Thu Jul 06 23:56:46 UTC 2023
Edited
by admin
on Thu Jul 06 23:56:46 UTC 2023
Record UNII
T7LMM4S8UR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DESETHYLISOTONITAZENE
Common Name English
1H-BENZIMIDAZOLE-1-ETHANAMINE, N-ETHYL-2-((4-(1-METHYLETHOXY)PHENYL)METHYL)-5-NITRO-
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA List_of_benzimidazole_opioids
Created by admin on Thu Jul 06 23:56:46 UTC 2023 , Edited by admin on Thu Jul 06 23:56:46 UTC 2023
Code System Code Type Description
FDA UNII
T7LMM4S8UR
Created by admin on Thu Jul 06 23:56:46 UTC 2023 , Edited by admin on Thu Jul 06 23:56:46 UTC 2023
PRIMARY
PUBCHEM
162623899
Created by admin on Thu Jul 06 23:56:46 UTC 2023 , Edited by admin on Thu Jul 06 23:56:46 UTC 2023
PRIMARY
CAS
2732926-24-6
Created by admin on Thu Jul 06 23:56:46 UTC 2023 , Edited by admin on Thu Jul 06 23:56:46 UTC 2023
PRIMARY
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