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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H18F3NO4
Molecular Weight 381.3457
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIFOPSIME

SMILES

C[C@@H](OC1=CC=C(OC2=CC=C(C=C2)C(F)(F)F)C=C1)C(=O)ON=C(C)C

InChI

InChIKey=IBHCSFXTRODDNR-CYBMUJFWSA-N
InChI=1S/C19H18F3NO4/c1-12(2)23-27-18(24)13(3)25-15-8-10-17(11-9-15)26-16-6-4-14(5-7-16)19(20,21)22/h4-11,13H,1-3H3/t13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H18F3NO4
Molecular Weight 381.3457
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:21:47 GMT 2023
Edited
by admin
on Sat Dec 16 09:21:47 GMT 2023
Record UNII
YW60G3404R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIFOPSIME
ISO  
Common Name English
2-PROPANONE, O-(1-OXO-2-(4-(4-(TRIFLUOROMETHYL)PHENOXY)PHENOXY)PROPYL)OXIME, (R)-
Systematic Name English
TRIFOPSIME [ISO]
Common Name English
2-PROPANONE, O-((2R)-1-OXO-2-(4-(4-(TRIFLUOROMETHYL)PHENOXY)PHENOXY)PROPYL)OXIME
Systematic Name English
Code System Code Type Description
CAS
72131-76-1
Created by admin on Sat Dec 16 09:21:47 GMT 2023 , Edited by admin on Sat Dec 16 09:21:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID60992851
Created by admin on Sat Dec 16 09:21:47 GMT 2023 , Edited by admin on Sat Dec 16 09:21:47 GMT 2023
PRIMARY
ALANWOOD
trifopsime
Created by admin on Sat Dec 16 09:21:47 GMT 2023 , Edited by admin on Sat Dec 16 09:21:47 GMT 2023
PRIMARY
FDA UNII
YW60G3404R
Created by admin on Sat Dec 16 09:21:47 GMT 2023 , Edited by admin on Sat Dec 16 09:21:47 GMT 2023
PRIMARY
PUBCHEM
12761569
Created by admin on Sat Dec 16 09:21:47 GMT 2023 , Edited by admin on Sat Dec 16 09:21:47 GMT 2023
PRIMARY