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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H13FN2O
Molecular Weight 220.2428
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole

SMILES

FC1=CC=CC2=C1C(=NO2)C3CCNCC3

InChI

InChIKey=GVMQXMFLUSCQJS-UHFFFAOYSA-N
InChI=1S/C12H13FN2O/c13-9-2-1-3-10-11(9)12(15-16-10)8-4-6-14-7-5-8/h1-3,8,14H,4-7H2

HIDE SMILES / InChI

Molecular Formula C12H13FN2O
Molecular Weight 220.2428
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 20:23:53 GMT 2025
Edited
by admin
on Wed Apr 02 20:23:53 GMT 2025
Record UNII
EGC85SGV4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Fluoro-3-(4-piperidinyl)-1,2-benzisoxazole
Systematic Name English
1,2-Benzisoxazole, 4-fluoro-3-(4-piperidinyl)-
Preferred Name English
Code System Code Type Description
FDA UNII
EGC85SGV4Q
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID10541217
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
CAS
95742-20-4
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY
PUBCHEM
13450902
Created by admin on Wed Apr 02 20:23:53 GMT 2025 , Edited by admin on Wed Apr 02 20:23:53 GMT 2025
PRIMARY