CVT

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Summary

Name:3,4,5-trimethoxy-~{N}-[(~{E})-naphthalen-1-ylmethylideneamino]benzamide
Formula:C21 H20 N2 O4
Formal charge:0
Molecular weight:364.395 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63,4,5-trimethoxy-~{N}-[(~{E})-naphthalen-1-ylmethylideneamino]benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C21H20N2O4/c1-25-18-11-16(12-19(26-2)20(18)27-3)21(24)23-22-13-15-9-6-8-14-7-4-5-10-17(14)15/h4-13H,1-3H3,(H,23,24)/b22-13+
InChIKeyInChI1.03MMNQIKXMVWECIH-LPYMAVHISA-N
SMILES_CANONICALCACTVS3.385COc1cc(cc(OC)c1OC)C(=O)N\N=C\c2cccc3ccccc23
SMILESCACTVS3.385COc1cc(cc(OC)c1OC)C(=O)NN=Cc2cccc3ccccc23
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1cc(cc(c1OC)OC)C(=O)N/N=C/c2cccc3c2cccc3
SMILESOpenEye OEToolkits2.0.6COc1cc(cc(c1OC)OC)C(=O)NN=Cc2cccc3c2cccc3
167132
PDB entries from 2020-07-29