Q85

~{N}-[(4-methoxyphenyl)methyl]-2-selanyl-benzamide

Created: 2020-05-26
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count34
Chiral Atom Count0
Bond Count35
Aromatic Bond Count12
2D diagram of Q85

Chemical Component Summary

Name~{N}-[(4-methoxyphenyl)methyl]-2-selanyl-benzamide
Systematic Name (OpenEye OEToolkits)~{N}-[(4-methoxyphenyl)methyl]-2-selanyl-benzamide
FormulaC15 H15 N O2 Se
Molecular Weight320.245
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385COc1ccc(CNC(=O)c2ccccc2[SeH])cc1
SMILESOpenEye OEToolkits2.0.7COc1ccc(cc1)CNC(=O)c2ccccc2[SeH]
Canonical SMILESCACTVS3.385 COc1ccc(CNC(=O)c2ccccc2[SeH])cc1
Canonical SMILESOpenEye OEToolkits2.0.7 COc1ccc(cc1)CNC(=O)c2ccccc2[SeH]
InChIInChI1.03 InChI=1S/C15H15NO2Se/c1-18-12-8-6-11(7-9-12)10-16-15(17)13-4-2-3-5-14(13)19/h2-9,19H,10H2,1H3,(H,16,17)
InChIKeyInChI1.03 YYKTWDKCQYEMIR-UHFFFAOYSA-N