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Details

Stereochemistry ACHIRAL
Molecular Formula C11H13F3N2O4S
Molecular Weight 326.292
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-PIPERAZIN-1-YL-2-(TRIFLUOROMETHYL)PHENYL) HYDROGEN SULFATE

SMILES

OS(=O)(=O)OC1=C(C=C(C=C1)N2CCNCC2)C(F)(F)F

InChI

InChIKey=QMCPCZUGGWYQRV-UHFFFAOYSA-N
InChI=1S/C11H13F3N2O4S/c12-11(13,14)9-7-8(16-5-3-15-4-6-16)1-2-10(9)20-21(17,18)19/h1-2,7,15H,3-6H2,(H,17,18,19)

HIDE SMILES / InChI

Molecular Formula C11H13F3N2O4S
Molecular Weight 326.292
Charge 0
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 Wed Apr 02 00:14:35 GMT 2025
Edited
by admin
on Wed Apr 02 00:14:35 GMT 2025
Record UNII
85N6L9F9K8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BI 400296 ZW
Preferred Name English
(4-PIPERAZIN-1-YL-2-(TRIFLUOROMETHYL)PHENYL) HYDROGEN SULFATE
Systematic Name English
FLIBANSERIN METABOLITE M8
Common Name English
Code System Code Type Description
PUBCHEM
156596567
Created by admin on Wed Apr 02 00:14:35 GMT 2025 , Edited by admin on Wed Apr 02 00:14:35 GMT 2025
PRIMARY
FDA UNII
85N6L9F9K8
Created by admin on Wed Apr 02 00:14:35 GMT 2025 , Edited by admin on Wed Apr 02 00:14:35 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR
URINE