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2MI

Summary
Name:2-METHYL-1H-INDOLE
Formula:C9 H9 N
Formal charge:0
Formula weight:131.174 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-methyl-1H-indole
OpenEye OEToolkits1.5.02-methyl-1H-indole

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04c1cccc2c1cc(n2)C
SMILES_CANONICALCACTVS3.341Cc1[nH]c2ccccc2c1
SMILESCACTVS3.341Cc1[nH]c2ccccc2c1
SMILES_CANONICALOpenEye OEToolkits1.5.0Cc1cc2ccccc2[nH]1
SMILESOpenEye OEToolkits1.5.0Cc1cc2ccccc2[nH]1
InChIInChI1.03InChI=1S/C9H9N/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6,10H,1H3
InChIKeyInChI1.03BHNHHSOHWZKFOX-UHFFFAOYSA-N

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PDB entries from 2024-07-17

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