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Details

Stereochemistry ACHIRAL
Molecular Formula C27H55N2O2.C2H5O4S
Molecular Weight 564.862
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOSTEARAMIDOPROPYL ETHYLMORPHOLINIUM ETHOSULFATE

SMILES

CCOS([O-])(=O)=O.CC[N+]1(CCCNC(=O)CCCCCCCCCCCCCCC(C)C)CCOCC1

InChI

InChIKey=WYAHGPPRCWPVHB-UHFFFAOYSA-N
InChI=1S/C27H54N2O2.C2H6O4S/c1-4-29(22-24-31-25-23-29)21-17-20-28-27(30)19-16-14-12-10-8-6-5-7-9-11-13-15-18-26(2)3;1-2-6-7(3,4)5/h26H,4-25H2,1-3H3;2H2,1H3,(H,3,4,5)

HIDE SMILES / InChI

Molecular Formula C27H55N2O2
Molecular Weight 439.7378
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H5O4S
Molecular Weight 125.124
Charge -1
Count
Stereochemistry ACHIRAL
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 20:00:44 GMT 2023
Edited
by admin
on Sat Dec 16 20:00:44 GMT 2023
Record UNII
88G241D5CX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOSTEARAMIDOPROPYL ETHYLMORPHOLINIUM ETHOSULFATE
INCI  
INCI  
Official Name English
ISOSTEARAMIDOPROPYL ETHYLMORPHOLINIUM ETHOSULFATE [INCI]
Common Name English
Code System Code Type Description
PUBCHEM
138059615
Created by admin on Sat Dec 16 20:00:44 GMT 2023 , Edited by admin on Sat Dec 16 20:00:44 GMT 2023
PRIMARY
FDA UNII
88G241D5CX
Created by admin on Sat Dec 16 20:00:44 GMT 2023 , Edited by admin on Sat Dec 16 20:00:44 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE