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Details

Stereochemistry ACHIRAL
Molecular Formula C24H43N2O.Cl
Molecular Weight 411.064
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(Stearamidomethyl)pyridinium chloride

SMILES

[Cl-].CCCCCCCCCCCCCCCCCC(=O)NC[N+]1=CC=CC=C1

InChI

InChIKey=XAVCZNYPFYJSJJ-UHFFFAOYSA-N
InChI=1S/C24H42N2O.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-24(27)25-23-26-21-18-16-19-22-26;/h16,18-19,21-22H,2-15,17,20,23H2,1H3;1H

HIDE SMILES / InChI
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
Molecular Formula C24H43N2O
Molecular Weight 375.611
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 13:05:14 GMT 2023
Edited
by admin
on Sat Dec 16 13:05:14 GMT 2023
Record UNII
VR479AB2A3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(Stearamidomethyl)pyridinium chloride
Systematic Name English
QUARPEL
Common Name English
N-(Stearamidomethyl)pyridinium chloride
Systematic Name English
Pyridinium, 1-(stearamidomethyl)-, chloride
Systematic Name English
Pyridinium, 1-[[(1-oxooctadecyl)amino]methyl]-, chloride (1:1)
Systematic Name English
NSC-30478
Code English
Code System Code Type Description
ECHA (EC/EINECS)
224-240-2
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
PUBCHEM
77944
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
CAS
4261-72-7
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
FDA UNII
VR479AB2A3
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID80962612
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
NSC
30478
Created by admin on Sat Dec 16 13:05:14 GMT 2023 , Edited by admin on Sat Dec 16 13:05:14 GMT 2023
PRIMARY
Related Record Type Details
Structure of Stearamidomethylpyridinium
PARENT -> SALT/SOLVATE
NIH
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