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Details

Stereochemistry ACHIRAL
Molecular Formula C18H13ClN2O4S
Molecular Weight 388.825
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6'-CARBOXY ETORICOXIB

SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(Cl)=CN=C2C3=CC=C(N=C3)C(O)=O

InChI

InChIKey=QIHJKHCGJLIAGS-UHFFFAOYSA-N
InChI=1S/C18H13ClN2O4S/c1-26(24,25)14-5-2-11(3-6-14)15-8-13(19)10-21-17(15)12-4-7-16(18(22)23)20-9-12/h2-10H,1H3,(H,22,23)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
6'-CARBOXY ETORICOXIB
Common Name English
(2,3'-BIPYRIDINE)-6'-CARBOXYLIC ACID, 5-CHLORO-3-(4-(METHYLSULFONYL)PHENYL)-
Systematic Name English
6'-CARBOXY-ETORICOXIB
Common Name English
6'-DESMETHYL-6'-CARBOXY ETORICOXIB
Common Name English
5-CHLORO-3-(4-(METHYLSULFONYL)PHENYL)(2,3'-BIPYRIDINE)-6'-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
349536-39-6
Created by admin on Sat Dec 16 17:53:07 GMT 2023 , Edited by admin on Sat Dec 16 17:53:07 GMT 2023
PRIMARY
FDA UNII
3G75T52B7D
Created by admin on Sat Dec 16 17:53:07 GMT 2023 , Edited by admin on Sat Dec 16 17:53:07 GMT 2023
PRIMARY
PUBCHEM
44266451
Created by admin on Sat Dec 16 17:53:07 GMT 2023 , Edited by admin on Sat Dec 16 17:53:07 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of ETORICOXIB
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