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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H22ClN3O
Molecular Weight 355.861
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isoquine

SMILES

CCN(CC)CC1=C(O)C=C(NC2=C3C=CC(Cl)=CC3=NC=C2)C=C1

InChI

InChIKey=QGFYFOHMBDMGBZ-UHFFFAOYSA-N
InChI=1S/C20H22ClN3O/c1-3-24(4-2)13-14-5-7-16(12-20(14)25)23-18-9-10-22-19-11-15(21)6-8-17(18)19/h5-12,25H,3-4,13H2,1-2H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C20H22ClN3O
Molecular Weight 355.861
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 Wed Apr 02 06:48:33 GMT 2025
Edited
by admin
on Wed Apr 02 06:48:33 GMT 2025
Record UNII
GKN7GKK6EY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Isoquine
Common Name English
5-((7-Chloranylquinolin-4-yl)-2-(diethylaminomethyl)phenol
Preferred Name English
5-[(7-Chloro-4-quinolinyl)amino]-2-[(diethylamino)methyl]phenol
Systematic Name English
Phenol, 5-[(7-chloro-4-quinolinyl)amino]-2-[(diethylamino)methyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
GKN7GKK6EY
Created by admin on Wed Apr 02 06:48:33 GMT 2025 , Edited by admin on Wed Apr 02 06:48:33 GMT 2025
PRIMARY
PUBCHEM
2166
Created by admin on Wed Apr 02 06:48:33 GMT 2025 , Edited by admin on Wed Apr 02 06:48:33 GMT 2025
PRIMARY
CAS
1643-45-4
Created by admin on Wed Apr 02 06:48:33 GMT 2025 , Edited by admin on Wed Apr 02 06:48:33 GMT 2025
PRIMARY