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FZ3

Summary
Name:1-[3-(4-chlorophenyl)propyl]imidazole
Formula:C12 H13 Cl N2
Formal charge:0
Formula weight:220.698 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-[3-(4-chlorophenyl)propyl]imidazole

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C12H13ClN2/c13-12-5-3-11(4-6-12)2-1-8-15-9-7-14-10-15/h3-7,9-10H,1-2,8H2
InChIKeyInChI1.03CLJJKXWBLJQDDT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Clc1ccc(CCCn2ccnc2)cc1
SMILESCACTVS3.385Clc1ccc(CCCn2ccnc2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(ccc1CCCn2ccnc2)Cl
SMILESOpenEye OEToolkits2.0.7c1cc(ccc1CCCn2ccnc2)Cl

221051

PDB entries from 2024-06-12

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