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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11N2O2.Cl
Molecular Weight 274.702
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Hydroxy-3-pyridin-1-ium-1-yl-1H-quinolin-2-one chloride

SMILES

[Cl-].OC1=C(C(=O)NC2=CC=CC=C12)[N+]3=CC=CC=C3

InChI

InChIKey=YIBGYBZDOLNDMP-UHFFFAOYSA-N
InChI=1S/C14H10N2O2.ClH/c17-13-10-6-2-3-7-11(10)15-14(18)12(13)16-8-4-1-5-9-16;/h1-9H,(H-,15,17,18);1H

HIDE SMILES / InChI

Molecular Formula C14H11N2O2
Molecular Weight 239.2493
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
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 Sat Dec 16 19:14:41 GMT 2023
Edited
by admin
on Sat Dec 16 19:14:41 GMT 2023
Record UNII
B55NJ3TJ28
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Hydroxy-3-pyridin-1-ium-1-yl-1H-quinolin-2-one chloride
Systematic Name English
Pyridinium, 1-(1,2-dihydro-4-hydroxy-2-oxo-3-quinolinyl)-, chloride (1:1)
Systematic Name English
NSC-355926
Code English
Pyridinium, 1-(1,2-dihydro-4-hydroxy-2-oxo-3-quinolinyl)-, chloride
Systematic Name English
1-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)pyridin-1-ium chloride
Systematic Name English
Code System Code Type Description
CAS
58013-67-5
Created by admin on Sat Dec 16 19:14:41 GMT 2023 , Edited by admin on Sat Dec 16 19:14:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID60206743
Created by admin on Sat Dec 16 19:14:41 GMT 2023 , Edited by admin on Sat Dec 16 19:14:41 GMT 2023
PRIMARY
PUBCHEM
54688358
Created by admin on Sat Dec 16 19:14:41 GMT 2023 , Edited by admin on Sat Dec 16 19:14:41 GMT 2023
PRIMARY
FDA UNII
B55NJ3TJ28
Created by admin on Sat Dec 16 19:14:41 GMT 2023 , Edited by admin on Sat Dec 16 19:14:41 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE