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A1EO6

Summary
Name:~{N}-(1-ethyl-2-oxidanylidene-benzo[cd]indol-6-yl)-2,5-dimethoxy-benzamide
Formula:C22 H20 N2 O4
Formal charge:0
Formula weight:376.405 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-(1-ethyl-2-oxidanylidene-benzo[cd]indol-6-yl)-2,5-dimethoxy-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C22H20N2O4/c1-4-24-18-10-9-17(14-6-5-7-15(20(14)18)22(24)26)23-21(25)16-12-13(27-2)8-11-19(16)28-3/h5-12H,4H2,1-3H3,(H,23,25)
InChIKeyInChI1.06CKSKYOPLEGIFCP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCN1C(=O)c2cccc3c(NC(=O)c4cc(OC)ccc4OC)ccc1c23
SMILESCACTVS3.385CCN1C(=O)c2cccc3c(NC(=O)c4cc(OC)ccc4OC)ccc1c23
SMILES_CANONICALOpenEye OEToolkits2.0.7CCN1c2ccc(c3c2c(ccc3)C1=O)NC(=O)c4cc(ccc4OC)OC
SMILESOpenEye OEToolkits2.0.7CCN1c2ccc(c3c2c(ccc3)C1=O)NC(=O)c4cc(ccc4OC)OC

255239

PDB entries from 2026-06-17

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