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UFJ

Summary
Name:N~1~-hydroxy-N~8~-(4-iodophenyl)octanediamide
Formula:C14 H19 I N2 O3
Formal charge:0
Formula weight:390.217 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N~1~-hydroxy-N~8~-(4-iodophenyl)octanediamide
OpenEye OEToolkits2.0.7~{N}-(4-iodophenyl)-~{N}'-oxidanyl-octanediamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1c(ccc(c1)NC(CCCCCCC(=O)NO)=O)I
InChIInChI1.03InChI=1S/C14H19IN2O3/c15-11-7-9-12(10-8-11)16-13(18)5-3-1-2-4-6-14(19)17-20/h7-10,20H,1-6H2,(H,16,18)(H,17,19)
InChIKeyInChI1.03BYVHZKAHBXINPL-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385ONC(=O)CCCCCCC(=O)Nc1ccc(I)cc1
SMILESCACTVS3.385ONC(=O)CCCCCCC(=O)Nc1ccc(I)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(ccc1NC(=O)CCCCCCC(=O)NO)I
SMILESOpenEye OEToolkits2.0.7c1cc(ccc1NC(=O)CCCCCCC(=O)NO)I

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PDB entries from 2024-07-17

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