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8OB

Summary
Name:4-[3,5-bis(chloranyl)pyridin-2-yl]oxyphenol
Formula:C11 H7 Cl2 N O2
Formal charge:0
Formula weight:256.085 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-[3,5-bis(chloranyl)pyridin-2-yl]oxyphenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H7Cl2NO2/c12-7-5-10(13)11(14-6-7)16-9-3-1-8(15)2-4-9/h1-6,15H
InChIKeyInChI1.03NWFAJOGQUGZVOS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc(Oc2ncc(Cl)cc2Cl)cc1
SMILESCACTVS3.385Oc1ccc(Oc2ncc(Cl)cc2Cl)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(ccc1O)Oc2c(cc(cn2)Cl)Cl
SMILESOpenEye OEToolkits2.0.6c1cc(ccc1O)Oc2c(cc(cn2)Cl)Cl

225946

PDB entries from 2024-10-09

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