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Summary

Name:[2-(1H-indol-4-yl)-1H-imidazol-4-yl](3,4,5-trimethoxyphenyl)methanone
Formula:C21 H19 N3 O4
Formal charge:0
Molecular weight:377.393 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01[2-(1H-indol-4-yl)-1H-imidazol-4-yl](3,4,5-trimethoxyphenyl)methanone
OpenEye OEToolkits2.0.6[2-(1~{H}-indol-4-yl)-1~{H}-imidazol-4-yl]-(3,4,5-trimethoxyphenyl)methanone

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01COc1c(OC)cc(cc1OC)C(=O)c2cnc(n2)c3c4c(ccc3)ncc4
InChIInChI1.03InChI=1S/C21H19N3O4/c1-26-17-9-12(10-18(27-2)20(17)28-3)19(25)16-11-23-21(24-16)14-5-4-6-15-13(14)7-8-22-15/h4-11,22H,1-3H3,(H,23,24)
InChIKeyInChI1.03WDMPGPZDSGODDF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(cc(OC)c1OC)C(=O)c2c[nH]c(n2)c3cccc4[nH]ccc34
SMILESCACTVS3.385COc1cc(cc(OC)c1OC)C(=O)c2c[nH]c(n2)c3cccc4[nH]ccc34
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1cc(cc(c1OC)OC)C(=O)c2c[nH]c(n2)c3cccc4c3cc[nH]4
SMILESOpenEye OEToolkits2.0.6COc1cc(cc(c1OC)OC)C(=O)c2c[nH]c(n2)c3cccc4c3cc[nH]4