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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H12F3N3O
Molecular Weight 307.2705
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-TRIFLUOROACETYLVARENICLINE

SMILES

FC(F)(F)C(=O)N1C[C@@H]2C[C@H](C1)C3=C2C=C4N=CC=NC4=C3

InChI

InChIKey=XDLHBWIAJAKYKF-DTORHVGOSA-N
InChI=1S/C15H12F3N3O/c16-15(17,18)14(22)21-6-8-3-9(7-21)11-5-13-12(4-10(8)11)19-1-2-20-13/h1-2,4-5,8-9H,3,6-7H2/t8-,9+

HIDE SMILES / InChI

Approval Year

Name Type Language
N-TRIFLUOROACETYLVARENICLINE
Common Name English
7,8,9,10-TETRAHYDRO-8-(TRIFLUOROACETYL)-6,10-METHANO-6H-PYRAZINO(2,3-H)(3)BENZAZEPINE
Systematic Name English
2,2,2-TRIFLUORO-1-(6,7,9,10-TETRAHYDRO-8H-6,10-METHANOAZEPINO(4,5-G)QUINOXALIN-8-YL)ETHAN-1-ONE
Systematic Name English
ETHANONE, 2,2,2-TRIFLUORO-1-(6,7,9,10-TETRAHYDRO-6,10-METHANO-8H-PYRAZINO(2,3-H)(3)BENZAZEPIN-8-YL)-
Common Name English
Code System Code Type Description
PUBCHEM
11243717
Created by admin on Sat Dec 16 18:47:58 GMT 2023 , Edited by admin on Sat Dec 16 18:47:58 GMT 2023
PRIMARY
CAS
230615-70-0
Created by admin on Sat Dec 16 18:47:58 GMT 2023 , Edited by admin on Sat Dec 16 18:47:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID40467395
Created by admin on Sat Dec 16 18:47:58 GMT 2023 , Edited by admin on Sat Dec 16 18:47:58 GMT 2023
PRIMARY
FDA UNII
22E2HV68CM
Created by admin on Sat Dec 16 18:47:58 GMT 2023 , Edited by admin on Sat Dec 16 18:47:58 GMT 2023
PRIMARY