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Details

Stereochemistry RACEMIC
Molecular Formula C52H48N6O6
Molecular Weight 852.9741
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRITYL CANDESARTAN CILEXETIL

SMILES

CCOC1=NC2=CC=CC(C(=O)OC(C)OC(=O)OC3CCCCC3)=C2N1CC4=CC=C(C=C4)C5=CC=CC=C5C6=NN=NN6C(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChIKey=MOHQWFWIPOOTGV-UHFFFAOYSA-N
InChI=1S/C52H48N6O6/c1-3-61-50-53-46-30-18-29-45(49(59)62-36(2)63-51(60)64-42-25-14-7-15-26-42)47(46)57(50)35-37-31-33-38(34-32-37)43-27-16-17-28-44(43)48-54-55-56-58(48)52(39-19-8-4-9-20-39,40-21-10-5-11-22-40)41-23-12-6-13-24-41/h4-6,8-13,16-24,27-34,36,42H,3,7,14-15,25-26,35H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C52H48N6O6
Molecular Weight 852.9741
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:50:23 GMT 2023
Edited
by admin
on Sat Dec 16 05:50:23 GMT 2023
Record UNII
006A6A2YSO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRITYL CANDESARTAN CILEXETIL
Common Name English
1H-BENZIMIDAZOLE-7-CARBOXYLIC ACID, 2-ETHOXY-1-((2'-(1-(TRIPHENYLMETHYL)-1H-TETRAZOL-5-YL)(1,1'-BIPHENYL)-4-YL)METHYL)-, 1-(((CYCLOHEXYLOXY)CARBONYL)OXY)ETHYL ESTER
Common Name English
CANDESARTAN CILEXETIL IMPURITY H [EP IMPURITY]
Common Name English
(±)-TRITYL CANDESARTAN CILEXETIL
Common Name English
(1RS)-1-(((CYCLOHEXYLOXY)CARBONYL)OXY)ETHYL 2-ETHOXY-1-((2'-(1-(TRIPHENYLMETHYL)-1H-TETRAZOL-5-YL)BIPHENYL-4-YL)METHYL)-1H-BENZIMIDAZOLE-7-CARBOXYLATE
Common Name English
2-ETHOXY-1-((2'-(1-TRITYL-1H-TETRAZOL-5-YL)-1,1'-BIPHENYL-4-YL)METHYL)-7-BENZIMIDAZOLECARBOXYLIC ACID 1-(CYCLOHEXYLOXYCARBONYLOXY)ETHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
006A6A2YSO
Created by admin on Sat Dec 16 05:50:23 GMT 2023 , Edited by admin on Sat Dec 16 05:50:23 GMT 2023
PRIMARY
CAS
170791-09-0
Created by admin on Sat Dec 16 05:50:23 GMT 2023 , Edited by admin on Sat Dec 16 05:50:23 GMT 2023
PRIMARY
PUBCHEM
11029254
Created by admin on Sat Dec 16 05:50:23 GMT 2023 , Edited by admin on Sat Dec 16 05:50:23 GMT 2023
PRIMARY
ECHA (EC/EINECS)
605-586-7
Created by admin on Sat Dec 16 05:50:23 GMT 2023 , Edited by admin on Sat Dec 16 05:50:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID901308612
Created by admin on Sat Dec 16 05:50:23 GMT 2023 , Edited by admin on Sat Dec 16 05:50:23 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
For the calculation of content, multiply the peak area by 1.6
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP