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Details

Stereochemistry ACHIRAL
Molecular Formula C23H25NO4.ClH
Molecular Weight 415.91
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

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

InChI

InChIKey=WDVNOYDPVLEXLL-UHFFFAOYSA-N
InChI=1S/C23H25NO4.ClH/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;1H

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

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:01:28 GMT 2023
Edited
by admin
on Fri Dec 15 16:01:28 GMT 2023
Record UNII
2CJ3607EA1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MITOFLAXONE 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE
Common Name English
4H-1-BENZOPYRAN-8-ACETIC ACID, 4-OXO-2-PHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE
Systematic Name English
LM-985
Code English
4H-1-BENZOPYRAN-8-ACETIC ACID, 4-OXO-2-PHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
NSC-293015
Code English
NCI-293015
Code English
Code System Code Type Description
PUBCHEM
55749
Created by admin on Fri Dec 15 16:01:28 GMT 2023 , Edited by admin on Fri Dec 15 16:01:28 GMT 2023
PRIMARY
FDA UNII
2CJ3607EA1
Created by admin on Fri Dec 15 16:01:28 GMT 2023 , Edited by admin on Fri Dec 15 16:01:28 GMT 2023
PRIMARY
CAS
87626-57-1
Created by admin on Fri Dec 15 16:01:28 GMT 2023 , Edited by admin on Fri Dec 15 16:01:28 GMT 2023
PRIMARY
NSC
293015
Created by admin on Fri Dec 15 16:01:28 GMT 2023 , Edited by admin on Fri Dec 15 16:01:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID30100770
Created by admin on Fri Dec 15 16:01:28 GMT 2023 , Edited by admin on Fri Dec 15 16:01:28 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE