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Details

Stereochemistry RACEMIC
Molecular Formula C22H38NO4
Molecular Weight 380.5414
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of TRIETHYL-(((2-((2-HYDROXY-2-(4-METHOXYPHENYL)-3,3-DIMETHYL-PENTANOYLOXY))ETHYL)))AMMONIUM

SMILES

CCC(C)(C)C(O)(C(=O)OCC[N+](CC)(CC)CC)C1=CC=C(OC)C=C1

InChI

InChIKey=FZFZYIINQFZMJV-UHFFFAOYSA-N
InChI=1S/C22H38NO4/c1-8-21(5,6)22(25,18-12-14-19(26-7)15-13-18)20(24)27-17-16-23(9-2,10-3)11-4/h12-15,25H,8-11,16-17H2,1-7H3/q+1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
AMMONIUM, TRIETHYL(2-HYDROXYETHYL)-, P-METHOXY-.ALPHA.-TERT-PENTYLMANDELATE
Preferred Name English
TRIETHYL-(((2-((2-HYDROXY-2-(4-METHOXYPHENYL)-3,3-DIMETHYL-PENTANOYLOXY))ETHYL)))AMMONIUM
Systematic Name English
ETHANAMINIUM, N,N,N-TRIETHYL-2-((2-HYDROXY-2-(4-METHOXYPHENYL)-3,3-DIMETHYL-1-OXOPENTYL)OXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
137321710
Created by admin on Wed Apr 02 03:48:25 GMT 2025 , Edited by admin on Wed Apr 02 03:48:25 GMT 2025
PRIMARY
FDA UNII
9KY3Y68BVC
Created by admin on Wed Apr 02 03:48:25 GMT 2025 , Edited by admin on Wed Apr 02 03:48:25 GMT 2025
PRIMARY
CAS
802300-41-0
Created by admin on Wed Apr 02 03:48:25 GMT 2025 , Edited by admin on Wed Apr 02 03:48:25 GMT 2025
PRIMARY
NIH
NCATS
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