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Details

Stereochemistry RACEMIC
Molecular Formula C22H19F6NO.ClH
Molecular Weight 463.844
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of WR-122455

SMILES

Cl.[H][C@@]1(CCCCN1)[C@@H](O)C2=CC3=C(C=C(C=C3)C(F)(F)F)C4=C2C=CC(=C4)C(F)(F)F

InChI

InChIKey=HKAMJBJQZVUJFZ-FDOHDBATSA-N
InChI=1S/C22H19F6NO.ClH/c23-21(24,25)13-5-4-12-9-18(20(30)19-3-1-2-8-29-19)15-7-6-14(22(26,27)28)11-17(15)16(12)10-13;/h4-7,9-11,19-20,29-30H,1-3,8H2;1H/t19-,20+;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
WR-122455
Common Name English
.ALPHA.-(3,6-BIS(TRIFLUOROMETHYL)-9-PHENANTHRENYL)-2-PIPERIDINEMETHANOL HYDROCHLORIDE
Systematic Name English
WR 122455
Code English
ALPHA (2-PIPERIDYL)-3,6-BIS(TRIFLUOROMETHYL)-9-PHENANTHRENEMETHANOL HYDROCHLORIDE
Systematic Name English
WR-122,455
Code English
Code System Code Type Description
MESH
C012496
Created by admin on Fri Dec 15 15:08:23 UTC 2023 , Edited by admin on Fri Dec 15 15:08:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID60956751
Created by admin on Fri Dec 15 15:08:23 UTC 2023 , Edited by admin on Fri Dec 15 15:08:23 UTC 2023
PRIMARY
PUBCHEM
76966160
Created by admin on Fri Dec 15 15:08:23 UTC 2023 , Edited by admin on Fri Dec 15 15:08:23 UTC 2023
PRIMARY
CAS
35318-40-2
Created by admin on Fri Dec 15 15:08:23 UTC 2023 , Edited by admin on Fri Dec 15 15:08:23 UTC 2023
PRIMARY
FDA UNII
V02QBL7JKT
Created by admin on Fri Dec 15 15:08:23 UTC 2023 , Edited by admin on Fri Dec 15 15:08:23 UTC 2023
PRIMARY