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

Details

Stereochemistry RACEMIC
Molecular Formula C18H15F3O4
Molecular Weight 352.3045
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DIFENOPENTEN

SMILES

CC(OC1=CC=C(OC2=CC=C(C=C2)C(F)(F)F)C=C1)\C=C\C(O)=O

InChI

InChIKey=ZJXKMHFMOPXCOJ-BIIKFXOESA-N
InChI=1S/C18H15F3O4/c1-12(2-11-17(22)23)24-14-7-9-16(10-8-14)25-15-5-3-13(4-6-15)18(19,20)21/h2-12H,1H3,(H,22,23)/b11-2+

HIDE SMILES / InChI

Molecular Formula C18H15F3O4
Molecular Weight 352.3045
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:21:49 GMT 2023
Edited
by admin
on Sat Dec 16 09:21:49 GMT 2023
Record UNII
O2J6M745HY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIFENOPENTEN
ISO  
Common Name English
2-PENTENOIC ACID, 4-(4-(4-(TRIFLUOROMETHYL)PHENOXY)PHENOXY)-, (2E)-
Systematic Name English
DIFENOPENTEN [ISO]
Common Name English
2-PENTENOIC ACID, 4-(4-(4-(TRIFLUOROMETHYL)PHENOXY)PHENOXY)-, (E)-(±)-
Systematic Name English
Code System Code Type Description
ALANWOOD
difenopenten
Created by admin on Sat Dec 16 09:21:50 GMT 2023 , Edited by admin on Sat Dec 16 09:21:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID20101658
Created by admin on Sat Dec 16 09:21:50 GMT 2023 , Edited by admin on Sat Dec 16 09:21:50 GMT 2023
PRIMARY
FDA UNII
O2J6M745HY
Created by admin on Sat Dec 16 09:21:50 GMT 2023 , Edited by admin on Sat Dec 16 09:21:50 GMT 2023
PRIMARY
CAS
81416-44-6
Created by admin on Sat Dec 16 09:21:50 GMT 2023 , Edited by admin on Sat Dec 16 09:21:50 GMT 2023
PRIMARY
PUBCHEM
6440677
Created by admin on Sat Dec 16 09:21:50 GMT 2023 , Edited by admin on Sat Dec 16 09:21:50 GMT 2023
PRIMARY