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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H21NO2.ClH
Molecular Weight 259.772
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMOXAMINE HYDROCHLORIDE, (S)-

SMILES

Cl.CC[C@H](N)CC1=CC(OC)=C(C)C=C1OC

InChI

InChIKey=HQMDHDKBZGKPGS-MERQFXBCSA-N
InChI=1S/C13H21NO2.ClH/c1-5-11(14)7-10-8-12(15-3)9(2)6-13(10)16-4;/h6,8,11H,5,7,14H2,1-4H3;1H/t11-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H21NO2
Molecular Weight 223.3113
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:49:44 GMT 2025
Edited
by admin
on Wed Apr 02 10:49:44 GMT 2025
Record UNII
7QU6RS2LCF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZENEETHANAMINE, .ALPHA.-ETHYL-2,5-DIMETHOXY-4-METHYL-, HYDROCHLORIDE, (S)-
Preferred Name English
DIMOXAMINE HYDROCHLORIDE, (S)-
Common Name English
Code System Code Type Description
PUBCHEM
70697545
Created by admin on Wed Apr 02 10:49:44 GMT 2025 , Edited by admin on Wed Apr 02 10:49:44 GMT 2025
PRIMARY
FDA UNII
7QU6RS2LCF
Created by admin on Wed Apr 02 10:49:44 GMT 2025 , Edited by admin on Wed Apr 02 10:49:44 GMT 2025
PRIMARY
CAS
52918-31-7
Created by admin on Wed Apr 02 10:49:44 GMT 2025 , Edited by admin on Wed Apr 02 10:49:44 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
RACEMATE -> ENANTIOMER