OQH

~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide

Created:2020-03-30
Last modified:  2020-04-08

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Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count0
Bond Count30
Aromatic Bond Count6
2D diagram of OQH

Chemical Component Summary

Name~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide
Systematic Name (OpenEye OEToolkits)~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide
FormulaC12 H15 N O2
Molecular Weight205.253
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CCNC(=O)CCC(=O)c1ccccc1
SMILESOpenEye OEToolkits2.0.7CCNC(=O)CCC(=O)c1ccccc1
Canonical SMILESCACTVS3.385 CCNC(=O)CCC(=O)c1ccccc1
Canonical SMILESOpenEye OEToolkits2.0.7 CCNC(=O)CCC(=O)c1ccccc1
InChIInChI1.03 InChI=1S/C12H15NO2/c1-2-13-12(15)9-8-11(14)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,15)
InChIKeyInChI1.03 DSZHWKIWJYHWTO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 94151129