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Details

Stereochemistry ACHIRAL
Molecular Formula C20H11F6N3O2
Molecular Weight 439.3107
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of JXL-069

SMILES

OC(=O)C(=C\C1=CN(CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=NC=CC=C13)\C#N

InChI

InChIKey=IGVIZFSCSSEYDA-WUXMJOGZSA-N
InChI=1S/C20H11F6N3O2/c21-19(22,23)14-4-11(5-15(7-14)20(24,25)26)9-29-10-13(6-12(8-27)18(30)31)16-2-1-3-28-17(16)29/h1-7,10H,9H2,(H,30,31)/b12-6+

HIDE SMILES / InChI

Approval Year

Name Type Language
JXL-069
Code English
JXL069
Code English
(2E)-3-[1-[[3,5-Bis(trifluoromethyl)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-2-propenoic acid
Systematic Name English
(2E)-3-(1-{[3,5-bis(trifluoromethyl)phenyl]methyl}-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-cyanoprop-2-enoic acid
Systematic Name English
2-Propenoic acid, 3-[1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-, (2E)-
Systematic Name English
Code System Code Type Description
CAS
2260696-63-5
Created by admin on Sat Dec 16 20:00:29 GMT 2023 , Edited by admin on Sat Dec 16 20:00:29 GMT 2023
PRIMARY
PUBCHEM
137374808
Created by admin on Sat Dec 16 20:00:29 GMT 2023 , Edited by admin on Sat Dec 16 20:00:29 GMT 2023
PRIMARY
FDA UNII
NPC95AG9EF
Created by admin on Sat Dec 16 20:00:29 GMT 2023 , Edited by admin on Sat Dec 16 20:00:29 GMT 2023
PRIMARY