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Details

Stereochemistry ACHIRAL
Molecular Formula C21H25F3N2O
Molecular Weight 378.4312
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-Dimethyl-2-[[1,2,3,4-tetrahydro-2-methyl-4-[4-(trifluoromethyl)phenyl]-7-isoquinolinyl]oxy]ethanamine

SMILES

CN(C)CCOC1=CC2=C(C=C1)C(CN(C)C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChIKey=YHTNLUNPBBEFHH-UHFFFAOYSA-N
InChI=1S/C21H25F3N2O/c1-25(2)10-11-27-18-8-9-19-16(12-18)13-26(3)14-20(19)15-4-6-17(7-5-15)21(22,23)24/h4-9,12,20H,10-11,13-14H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C21H25F3N2O
Molecular Weight 378.4312
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:19:20 GMT 2025
Edited
by admin
on Wed Apr 02 19:19:20 GMT 2025
Record UNII
EXB3X82F4F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-Dimethyl-2-[[1,2,3,4-tetrahydro-2-methyl-4-[4-(trifluoromethyl)phenyl]-7-isoquinolinyl]oxy]ethanamine
Systematic Name English
Ethanamine, N,N-dimethyl-2-[[1,2,3,4-tetrahydro-2-methyl-4-[4-(trifluoromethyl)phenyl]-7-isoquinolinyl]oxy]-
Preferred Name English
Code System Code Type Description
CAS
62888-75-9
Created by admin on Wed Apr 02 19:19:20 GMT 2025 , Edited by admin on Wed Apr 02 19:19:20 GMT 2025
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EPA CompTox
DTXSID80978637
Created by admin on Wed Apr 02 19:19:20 GMT 2025 , Edited by admin on Wed Apr 02 19:19:20 GMT 2025
PRIMARY
PUBCHEM
3047064
Created by admin on Wed Apr 02 19:19:20 GMT 2025 , Edited by admin on Wed Apr 02 19:19:20 GMT 2025
PRIMARY
FDA UNII
EXB3X82F4F
Created by admin on Wed Apr 02 19:19:20 GMT 2025 , Edited by admin on Wed Apr 02 19:19:20 GMT 2025
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