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Details

Stereochemistry ACHIRAL
Molecular Formula C17H11Cl3N2O2
Molecular Weight 381.64
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-4-METHYLPYRAZOLE-3-CARBOXYLIC ACID

SMILES

CC1=C(N(N=C1C(O)=O)C2=C(Cl)C=C(Cl)C=C2)C3=CC=C(Cl)C=C3

InChI

InChIKey=CYAYCOCJAVHQSD-UHFFFAOYSA-N
InChI=1S/C17H11Cl3N2O2/c1-9-15(17(23)24)21-22(14-7-6-12(19)8-13(14)20)16(9)10-2-4-11(18)5-3-10/h2-8H,1H3,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C17H11Cl3N2O2
Molecular Weight 381.64
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 18:12:08 GMT 2023
Edited
by admin
on Sat Dec 16 18:12:08 GMT 2023
Record UNII
9Q6ZA9Y42R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-4-METHYLPYRAZOLE-3-CARBOXYLIC ACID
Systematic Name English
1-(2,4-DICHLOROPHENYL)-5-(4-CHLOROPHENYL)-4-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
Systematic Name English
1H-PYRAZOLE-3-CARBOXYLIC ACID, 5-(4-CHLOROPHENYL)-1-(2,4-DICHLOROPHENYL)-4-METHYL-
Systematic Name English
RIMONABANT CARBOXYLIC ACID
Common Name English
Code System Code Type Description
PUBCHEM
1519421
Created by admin on Sat Dec 16 18:12:08 GMT 2023 , Edited by admin on Sat Dec 16 18:12:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID60364034
Created by admin on Sat Dec 16 18:12:08 GMT 2023 , Edited by admin on Sat Dec 16 18:12:08 GMT 2023
PRIMARY
FDA UNII
9Q6ZA9Y42R
Created by admin on Sat Dec 16 18:12:08 GMT 2023 , Edited by admin on Sat Dec 16 18:12:08 GMT 2023
PRIMARY
CAS
162758-35-2
Created by admin on Sat Dec 16 18:12:08 GMT 2023 , Edited by admin on Sat Dec 16 18:12:08 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE