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7RT

Summary
Name:N-methyl-1H-indole-4-carboxamide
Formula:C10 H10 N2 O
Formal charge:0
Formula weight:174.199 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-methyl-1~{H}-indole-4-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H10N2O/c1-11-10(13)8-3-2-4-9-7(8)5-6-12-9/h2-6,12H,1H3,(H,11,13)
InChIKeyInChI1.03SLFIWTNAKPDBJR-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CNC(=O)c1cccc2[nH]ccc12
SMILESCACTVS3.385CNC(=O)c1cccc2[nH]ccc12
SMILES_CANONICALOpenEye OEToolkits2.0.7CNC(=O)c1cccc2c1cc[nH]2
SMILESOpenEye OEToolkits2.0.7CNC(=O)c1cccc2c1cc[nH]2

223532

数据于2024-08-07公开中

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