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Details

Stereochemistry ACHIRAL
Molecular Formula C30H53N2O.Cl
Molecular Weight 493.208
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BENZYL(3-OLEAMIDOPROPYL)DIMETHYLAMMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCC\C=C/CCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChIKey=WFGZPNYNBFKOOW-AFEZEDKISA-N
InChI=1S/C30H52N2O.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-30(33)31-26-22-27-32(2,3)28-29-23-19-18-20-24-29;/h11-12,18-20,23-24H,4-10,13-17,21-22,25-28H2,1-3H3;1H/b12-11-;

HIDE SMILES / InChI

Approval Year

Name Type Language
BENZYL(3-OLEAMIDOPROPYL)DIMETHYLAMMONIUM CHLORIDE
Systematic Name English
BENZENEMETHANAMINIUM, N,N-DIMETHYL-N-(3-(((9Z)-1-OXO-9-OCTADECEN-1-YL)AMINO)PROPYL)-, CHLORIDE (1:1)
Preferred Name English
BENZENEMETHANAMINIUM, N,N-DIMETHYL-N-(3-((1-OXO-9-OCTADECENYL)AMINO)PROPYL)-, CHLORIDE, (Z)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30887366
Created by admin on Tue Apr 01 16:22:33 GMT 2025 , Edited by admin on Tue Apr 01 16:22:33 GMT 2025
PRIMARY
ECHA (EC/EINECS)
270-048-7
Created by admin on Tue Apr 01 16:22:33 GMT 2025 , Edited by admin on Tue Apr 01 16:22:33 GMT 2025
PRIMARY
CAS
68400-58-8
Created by admin on Tue Apr 01 16:22:33 GMT 2025 , Edited by admin on Tue Apr 01 16:22:33 GMT 2025
PRIMARY
PUBCHEM
20838894
Created by admin on Tue Apr 01 16:22:33 GMT 2025 , Edited by admin on Tue Apr 01 16:22:33 GMT 2025
PRIMARY
FDA UNII
P48GI4F1J2
Created by admin on Tue Apr 01 16:22:33 GMT 2025 , Edited by admin on Tue Apr 01 16:22:33 GMT 2025
PRIMARY