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Details

Stereochemistry ACHIRAL
Molecular Formula C22H19N2O.I
Molecular Weight 454.3035
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-(8-HYDROXY-5-METHYL-7-QUINOLYL)VINYL)-1-METHYL QUINOLINIUM IODIDE

SMILES

[I-].CC1=C2C=CC=NC2=C(O)C(\C=C\C3=C4C=CC=CC4=[N+](C)C=C3)=C1

InChI

InChIKey=MNAHQEBGYKILRR-UHFFFAOYSA-N
InChI=1S/C22H18N2O.HI/c1-15-14-17(22(25)21-18(15)7-5-12-23-21)10-9-16-11-13-24(2)20-8-4-3-6-19(16)20;/h3-14H,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula HI
Molecular Weight 127.91241
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C22H18N2O
Molecular Weight 326.3911
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:11:31 GMT 2025
Edited
by admin
on Tue Apr 01 20:11:31 GMT 2025
Record UNII
15WKR22F0W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2-(8-HYDROXY-5-METHYL-7-QUINOLYL)VINYL)-1-METHYL QUINOLINIUM IODIDE
Systematic Name English
NSC-86373
Preferred Name English
QUINOLINIUM, 4-(2-(8-HYDROXY-5-METHYL-7-QUINOLINYL)ETHENYL)-1-METHYL-, IODIDE
Systematic Name English
QUINOLINIUM, 4-(2-(8-HYDROXY-5-METHYL-7-QUINOLYL)VINYL)-1-METHYL-, IODIDE
Systematic Name English
QUINOLINIUM, 4-(2-(8-HYDROXY-5-METHYL-7-QUINOLINYL)ETHENYL)-1-METHYL-, IODIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
135534478
Created by admin on Tue Apr 01 20:11:31 GMT 2025 , Edited by admin on Tue Apr 01 20:11:31 GMT 2025
PRIMARY
CAS
10277-40-4
Created by admin on Tue Apr 01 20:11:31 GMT 2025 , Edited by admin on Tue Apr 01 20:11:31 GMT 2025
PRIMARY
NSC
86373
Created by admin on Tue Apr 01 20:11:31 GMT 2025 , Edited by admin on Tue Apr 01 20:11:31 GMT 2025
PRIMARY
FDA UNII
15WKR22F0W
Created by admin on Tue Apr 01 20:11:31 GMT 2025 , Edited by admin on Tue Apr 01 20:11:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID40908036
Created by admin on Tue Apr 01 20:11:31 GMT 2025 , Edited by admin on Tue Apr 01 20:11:31 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE