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Details

Stereochemistry ACHIRAL
Molecular Formula C18H25Cl3O2
Molecular Weight 379.749
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of K-111

SMILES

OC(=O)C(Cl)(Cl)CCCCCCCCCCC1=CC=C(Cl)C=C1

InChI

InChIKey=GPCJDSXBRMKASP-UHFFFAOYSA-N
InChI=1S/C18H25Cl3O2/c19-16-12-10-15(11-13-16)9-7-5-3-1-2-4-6-8-14-18(20,21)17(22)23/h10-13H,1-9,14H2,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C18H25Cl3O2
Molecular Weight 379.749
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 Sat Dec 16 18:02:22 UTC 2023
Edited
by admin
on Sat Dec 16 18:02:22 UTC 2023
Record UNII
TM9XQR923G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
K-111
Code English
K111
Code English
K111 (PHARMACEUTICAL)
Code English
.ALPHA.,.ALPHA.,4-TRICHLOROBENZENEDODECANOIC ACID
Common Name English
BM-17.0744
Code English
BM170744
Code English
BM-170744
Code English
BENZENEDODECANOIC ACID, .ALPHA.,.ALPHA.,4-TRICHLORO-
Systematic Name English
2,2-DICHLORO-12-(4-CHLOROPHENYL)DODECANOIC ACID
Systematic Name English
Code System Code Type Description
CAS
221564-97-2
Created by admin on Sat Dec 16 18:02:22 UTC 2023 , Edited by admin on Sat Dec 16 18:02:22 UTC 2023
PRIMARY
FDA UNII
TM9XQR923G
Created by admin on Sat Dec 16 18:02:22 UTC 2023 , Edited by admin on Sat Dec 16 18:02:22 UTC 2023
PRIMARY
EPA CompTox
DTXSID901286589
Created by admin on Sat Dec 16 18:02:22 UTC 2023 , Edited by admin on Sat Dec 16 18:02:22 UTC 2023
PRIMARY
PUBCHEM
9929731
Created by admin on Sat Dec 16 18:02:22 UTC 2023 , Edited by admin on Sat Dec 16 18:02:22 UTC 2023
PRIMARY
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