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Details

Stereochemistry ACHIRAL
Molecular Formula C18H31N2O.Cl
Molecular Weight 326.905
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

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

InChI

InChIKey=DMMZHYHTXWCNMW-UHFFFAOYSA-N
InChI=1S/C18H30N2O.ClH/c1-4-5-7-13-18(21)19-14-10-15-20(2,3)16-17-11-8-6-9-12-17;/h6,8-9,11-12H,4-5,7,10,13-16H2,1-3H3;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 C18H31N2O
Molecular Weight 291.4515
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:22:27 GMT 2023
Edited
by admin
on Sat Dec 16 11:22:27 GMT 2023
Record UNII
7D724BZ9IY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYL(3-HEXANOAMIDOPROPYL)DIMETHYLAMMONIUM CHLORIDE
Common Name English
BENZENEMETHANAMINIUM, N,N-DIMETHYL-N-(3-((1-OXOHEXYL)AMINO)PROPYL)-, CHLORIDE (1:1)
Systematic Name English
AMMONIUM, BENZYL(3-HEXANAMIDOPROPYL)DIMETHYL-, CHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
7D724BZ9IY
Created by admin on Sat Dec 16 11:22:27 GMT 2023 , Edited by admin on Sat Dec 16 11:22:27 GMT 2023
PRIMARY
PUBCHEM
109374174
Created by admin on Sat Dec 16 11:22:27 GMT 2023 , Edited by admin on Sat Dec 16 11:22:27 GMT 2023
PRIMARY
CAS
879639-55-1
Created by admin on Sat Dec 16 11:22:27 GMT 2023 , Edited by admin on Sat Dec 16 11:22:27 GMT 2023
PRIMARY