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L8U

Summary
Name:2-bromanyl-1-(4-bromanyl-2-oxidanyl-phenyl)ethanone
Formula:C8 H6 Br2 O2
Formal charge:0
Formula weight:293.94 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-bromanyl-1-(4-bromanyl-2-oxidanyl-phenyl)ethanone

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C8H6Br2O2/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,11H,4H2
InChIKeyInChI1.06MGBNHYHFAXNJLU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cc(Br)ccc1C(=O)CBr
SMILESCACTVS3.385Oc1cc(Br)ccc1C(=O)CBr
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(c(cc1Br)O)C(=O)CBr
SMILESOpenEye OEToolkits2.0.7c1cc(c(cc1Br)O)C(=O)CBr

221051

PDB entries from 2024-06-12

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