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Details

Stereochemistry ACHIRAL
Molecular Formula C13H15IN2O2
Molecular Weight 358.1749
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of tert-Butyl 2-(iodomethyl)benzimidazole-1-carboxylate

SMILES

CC(C)(C)OC(=O)N1C(CI)=NC2=C1C=CC=C2

InChI

InChIKey=NOMWBZZQJMSOSC-UHFFFAOYSA-N
InChI=1S/C13H15IN2O2/c1-13(2,3)18-12(17)16-10-7-5-4-6-9(10)15-11(16)8-14/h4-7H,8H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
tert-Butyl 2-(iodomethyl)benzimidazole-1-carboxylate
Systematic Name English
1,1-Dimethylethyl 2-(iodomethyl)-1H-benzimidazole-1-carboxylate
Preferred Name English
1H-Benzimidazole-1-carboxylic acid, 2-(iodomethyl)-, 1,1-dimethylethyl ester
Systematic Name English
Code System Code Type Description
CAS
1058225-52-7
Created by admin on Wed Apr 02 18:22:44 GMT 2025 , Edited by admin on Wed Apr 02 18:22:44 GMT 2025
PRIMARY
PUBCHEM
84819983
Created by admin on Wed Apr 02 18:22:44 GMT 2025 , Edited by admin on Wed Apr 02 18:22:44 GMT 2025
PRIMARY
FDA UNII
GK776EQ5YR
Created by admin on Wed Apr 02 18:22:44 GMT 2025 , Edited by admin on Wed Apr 02 18:22:44 GMT 2025
PRIMARY
NIH
NCATS
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