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Details

Stereochemistry ACHIRAL
Molecular Formula C38H75N2O6
Molecular Weight 656.0119
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of 2-[Bis[2-[(1-oxotetradecyl)oxy]ethyl]amino]-N-(2-hydroxyethyl)-N,N-dimethyl-2-oxoethanaminium

SMILES

CCCCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCCCC)C(=O)C[N+](C)(C)CCO

InChI

InChIKey=SPVYSEMELUGEIW-UHFFFAOYSA-N
InChI=1S/C38H75N2O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-37(43)45-33-29-39(36(42)35-40(3,4)31-32-41)30-34-46-38(44)28-26-24-22-20-18-16-14-12-10-8-6-2/h41H,5-35H2,1-4H3/q+1

HIDE SMILES / InChI

Molecular Formula C38H75N2O6
Molecular Weight 656.0119
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 12:27:39 GMT 2025
Edited
by admin
on Wed Apr 02 12:27:39 GMT 2025
Record UNII
A8QS6CY8E2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[Bis[2-[(1-oxotetradecyl)oxy]ethyl]amino]-N-(2-hydroxyethyl)-N,N-dimethyl-2-oxoethanaminium
Systematic Name English
Ethanaminium, 2-[bis[2-[(1-oxotetradecyl)oxy]ethyl]amino]-N-(2-hydroxyethyl)-N,N-dimethyl-2-oxo-
Preferred Name English
Code System Code Type Description
FDA UNII
A8QS6CY8E2
Created by admin on Wed Apr 02 12:27:39 GMT 2025 , Edited by admin on Wed Apr 02 12:27:39 GMT 2025
PRIMARY
CAS
1415959-46-4
Created by admin on Wed Apr 02 12:27:39 GMT 2025 , Edited by admin on Wed Apr 02 12:27:39 GMT 2025
PRIMARY
PUBCHEM
71475720
Created by admin on Wed Apr 02 12:27:39 GMT 2025 , Edited by admin on Wed Apr 02 12:27:39 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT