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6WS

Summary
Name:1-[2,2-bis(chloranyl)-1-(4-chlorophenyl)ethenyl]-4-chloranyl-benzene
Formula:C14 H8 Cl4
Formal charge:0
Formula weight:318.025 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.51-[2,2-bis(chloranyl)-1-(4-chlorophenyl)ethenyl]-4-chloranyl-benzene

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H
InChIKeyInChI1.03UCNVFOCBFJOQAL-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1ccc(cc1)C(=C(Cl)Cl)c2ccc(Cl)cc2
SMILESCACTVS3.385Clc1ccc(cc1)C(=C(Cl)Cl)c2ccc(Cl)cc2
SMILES_CANONICALOpenEye OEToolkits2.0.5c1cc(ccc1C(=C(Cl)Cl)c2ccc(cc2)Cl)Cl
SMILESOpenEye OEToolkits2.0.5c1cc(ccc1C(=C(Cl)Cl)c2ccc(cc2)Cl)Cl

218500

PDB entries from 2024-04-17

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