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FK1

Summary
Name:6-bromo-1H-indole
Formula:C8 H6 Br N
Formal charge:0
Formula weight:196.044 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.016-bromo-1H-indole
OpenEye OEToolkits1.7.66-bromanyl-1H-indole

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Brc1ccc2c(c1)ncc2
InChIInChI1.03InChI=1S/C8H6BrN/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,10H
InChIKeyInChI1.03MAWGHOPSCKCTPA-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Brc1ccc2cc[nH]c2c1
SMILESCACTVS3.385Brc1ccc2cc[nH]c2c1
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc(cc2c1cc[nH]2)Br
SMILESOpenEye OEToolkits1.7.6c1cc(cc2c1cc[nH]2)Br

217705

PDB entries from 2024-03-27

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