U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C17H16F6N2O
Molecular Weight 378.3122
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of REL-(.ALPHA.R)-.ALPHA.-(2R)-2-PIPERIDINYL-2,8-BIS(TRIFLUOROMETHYL)-4-QUINOLINEMETHANOL

SMILES

[H][C@]1(CCCCN1)[C@@H](O)C2=C3C=CC=C(C3=NC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChIKey=XEEQGYMUWCZPDN-WFASDCNBSA-N
InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2/t12-,15-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
REL-(.ALPHA.R)-.ALPHA.-(2R)-2-PIPERIDINYL-2,8-BIS(TRIFLUOROMETHYL)-4-QUINOLINEMETHANOL
Systematic Name English
4-QUINOLINEMETHANOL, .ALPHA.-(2R)-2-PIPERIDINYL-2,8-BIS(TRIFLUOROMETHYL)-, (.ALPHA.R)-REL-
Systematic Name English
WR177602
Code English
MEFLOQUINE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
(SR)-(2,8-BIS(TRIFLUOROMETHYL)-4-QUINOLYL)-((2SR)-2-PIPERIDYL)METHANOL
Systematic Name English
WR-177602
Code English
Code System Code Type Description
FDA UNII
GB2GL4S36Z
Created by admin on Sat Dec 16 15:11:33 GMT 2023 , Edited by admin on Sat Dec 16 15:11:33 GMT 2023
PRIMARY
PUBCHEM
3000516
Created by admin on Sat Dec 16 15:11:33 GMT 2023 , Edited by admin on Sat Dec 16 15:11:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID901146248
Created by admin on Sat Dec 16 15:11:33 GMT 2023 , Edited by admin on Sat Dec 16 15:11:33 GMT 2023
PRIMARY
CAS
58737-31-8
Created by admin on Sat Dec 16 15:11:33 GMT 2023 , Edited by admin on Sat Dec 16 15:11:33 GMT 2023
PRIMARY