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XEH

Summary
Name:(1E)-1-[(4-chlorophenyl)methylidene]-2-(4-fluorophenyl)hydrazine
Formula:C13 H10 Cl F N2
Formal charge:0
Formula weight:248.683 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(1E)-1-[(4-chlorophenyl)methylidene]-2-(4-fluorophenyl)hydrazine
OpenEye OEToolkits2.0.7~{N}-[(4-chlorophenyl)methylideneamino]-4-fluoranyl-aniline

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Clc1ccc(/C=N/Nc2ccc(F)cc2)cc1
InChIInChI1.06InChI=1S/C13H10ClFN2/c14-11-3-1-10(2-4-11)9-16-17-13-7-5-12(15)6-8-13/h1-9,17H/b16-9+
InChIKeyInChI1.06DFIGWNLJZASRTJ-CXUHLZMHSA-N
SMILES_CANONICALCACTVS3.385Fc1ccc(N\N=C\c2ccc(Cl)cc2)cc1
SMILESCACTVS3.385Fc1ccc(NN=Cc2ccc(Cl)cc2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(ccc1C=NNc2ccc(cc2)F)Cl
SMILESOpenEye OEToolkits2.0.7c1cc(ccc1C=NNc2ccc(cc2)F)Cl

223532

PDB entries from 2024-08-07

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