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8NY

Summary
Name:5-iodanyl-1H-indazole
Formula:C7 H5 I N2
Formal charge:0
Formula weight:244.032 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.7.65-iodanyl-1H-indazole

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H5IN2/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,(H,9,10)
InChIKeyInChI1.03CGCHCLICSHIAAM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Ic1ccc2[nH]ncc2c1
SMILESCACTVS3.385Ic1ccc2[nH]ncc2c1
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc2c(cc1I)cn[nH]2
SMILESOpenEye OEToolkits1.7.6c1cc2c(cc1I)cn[nH]2

221051

PDB entries from 2024-06-12

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