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Details

Stereochemistry ACHIRAL
Molecular Formula C14H23IN2O.2ClH
Molecular Weight 435.172
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N',N'-TRIMETHYL-N-(2-HYDROXY-5-IODO-3-METHYLBENZYL)-1,3-PROPANEDIAMINE DIHYDROCHLORIDE

SMILES

Cl.Cl.CN(C)CCCN(C)CC1=CC(I)=CC(C)=C1O

InChI

InChIKey=SXPLHSWEPJPKDJ-UHFFFAOYSA-N
InChI=1S/C14H23IN2O.2ClH/c1-11-8-13(15)9-12(14(11)18)10-17(4)7-5-6-16(2)3;;/h8-9,18H,5-7,10H2,1-4H3;2*1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
N,N',N'-TRIMETHYL-N-(2-HYDROXY-5-IODO-3-METHYLBENZYL)-1,3-PROPANEDIAMINE DIHYDROCHLORIDE
Systematic Name English
N,N,N'-TRIMETHYL-N'-(2-HYDROXY-3-METHYL-5-IODO-BENZYL)-1,3-PROPANDIAMINE DIHYDROCHLORIDE
Preferred Name English
PHENOL, 2-(((3-(DIMETHYLAMINO)PROPYL)METHYLAMINO)METHYL)-4-IODO-6-METHYL-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
FDA UNII
2ZCU8ZI7Z2
Created by admin on Mon Mar 31 18:08:55 GMT 2025 , Edited by admin on Mon Mar 31 18:08:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID80426067
Created by admin on Mon Mar 31 18:08:55 GMT 2025 , Edited by admin on Mon Mar 31 18:08:55 GMT 2025
PRIMARY
PUBCHEM
2737336
Created by admin on Mon Mar 31 18:08:55 GMT 2025 , Edited by admin on Mon Mar 31 18:08:55 GMT 2025
PRIMARY
CAS
89815-43-0
Created by admin on Mon Mar 31 18:08:55 GMT 2025 , Edited by admin on Mon Mar 31 18:08:55 GMT 2025
PRIMARY
NIH
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