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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H25NO4
Molecular Weight 379.4489
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MITOFLAXONE 2-(DIETHYLAMINO)ETHYL ESTER

SMILES

CCN(CC)CCOC(=O)CC1=C2OC(=CC(=O)C2=CC=C1)C3=CC=CC=C3

InChI

InChIKey=ZMLZQKCBYPEYMG-UHFFFAOYSA-N
InChI=1S/C23H25NO4/c1-3-24(4-2)13-14-27-22(26)15-18-11-8-12-19-20(25)16-21(28-23(18)19)17-9-6-5-7-10-17/h5-12,16H,3-4,13-15H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C23H25NO4
Molecular Weight 379.4489
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 18:45:28 GMT 2025
Edited
by admin
on Mon Mar 31 18:45:28 GMT 2025
Record UNII
3MQU39G359
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4H-1-BENZOPYRAN-8-ACETIC ACID, 4-OXO-2-PHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER
Preferred Name English
MITOFLAXONE 2-(DIETHYLAMINO)ETHYL ESTER
Common Name English
Code System Code Type Description
CAS
87626-56-0
Created by admin on Mon Mar 31 18:45:28 GMT 2025 , Edited by admin on Mon Mar 31 18:45:28 GMT 2025
PRIMARY
FDA UNII
3MQU39G359
Created by admin on Mon Mar 31 18:45:28 GMT 2025 , Edited by admin on Mon Mar 31 18:45:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID601007706
Created by admin on Mon Mar 31 18:45:28 GMT 2025 , Edited by admin on Mon Mar 31 18:45:28 GMT 2025
PRIMARY
PUBCHEM
55750
Created by admin on Mon Mar 31 18:45:28 GMT 2025 , Edited by admin on Mon Mar 31 18:45:28 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT