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Details

Stereochemistry MIXED
Molecular Formula C22H40NO2.Cl
Molecular Weight 386.012
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of N-METHYL-N-(2-HYDROXYETHYL)-N-(2-HYDROXYDODECYL)-N-BENZYL AMMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCC(O)C[N+](C)(CCO)CC1=CC=CC=C1

InChI

InChIKey=VNHUKFSXXYAFRU-UHFFFAOYSA-M
InChI=1S/C22H40NO2.ClH/c1-3-4-5-6-7-8-9-13-16-22(25)20-23(2,17-18-24)19-21-14-11-10-12-15-21;/h10-12,14-15,22,24-25H,3-9,13,16-20H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
N-METHYL-N-(2-HYDROXYETHYL)-N-(2-HYDROXYDODECYL)-N-BENZYL AMMONIUM CHLORIDE
Systematic Name English
BENZENEMETHANAMINIUM, N-(2-HYDROXYDODECYL)-N-(2-HYDROXYETHYL)-N-METHYL-, CHLORIDE (1:1)
Preferred Name English
Code System Code Type Description
CAS
19845-41-1
Created by admin on Tue Apr 01 22:17:25 GMT 2025 , Edited by admin on Tue Apr 01 22:17:25 GMT 2025
PRIMARY
FDA UNII
446J5HAO2J
Created by admin on Tue Apr 01 22:17:25 GMT 2025 , Edited by admin on Tue Apr 01 22:17:25 GMT 2025
PRIMARY
PUBCHEM
32332
Created by admin on Tue Apr 01 22:17:25 GMT 2025 , Edited by admin on Tue Apr 01 22:17:25 GMT 2025
PRIMARY
NIH
NCATS
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