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MGZ

Summary
Name:(2R)-(4-chlorophenyl)[3-(trifluoromethyl)phenoxy]ethanoic acid
Synonyms:Metaglidasen
Formula:C15 H10 Cl F3 O3
Formal charge:0
Formula weight:330.686 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2R)-(4-chlorophenyl)[3-(trifluoromethyl)phenoxy]ethanoic acid
OpenEye OEToolkits1.7.6(2R)-2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]ethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Clc1ccc(cc1)C(Oc2cc(ccc2)C(F)(F)F)C(=O)O
InChIInChI1.03InChI=1S/C15H10ClF3O3/c16-11-6-4-9(5-7-11)13(14(20)21)22-12-3-1-2-10(8-12)15(17,18)19/h1-8,13H,(H,20,21)/t13-/m1/s1
InChIKeyInChI1.03DDTQLPXXNHLBAB-CYBMUJFWSA-N
SMILES_CANONICALCACTVS3.385OC(=O)[C@H](Oc1cccc(c1)C(F)(F)F)c2ccc(Cl)cc2
SMILESCACTVS3.385OC(=O)[CH](Oc1cccc(c1)C(F)(F)F)c2ccc(Cl)cc2
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(cc(c1)O[C@H](c2ccc(cc2)Cl)C(=O)O)C(F)(F)F
SMILESOpenEye OEToolkits1.7.6c1cc(cc(c1)OC(c2ccc(cc2)Cl)C(=O)O)C(F)(F)F

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PDB entries from 2024-07-17

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