WLG

1-(5-azaspiro[2.5]octan-5-yl)-2-(difluoromethoxy)ethan-1-one

Created: 2020-10-30
Last modified:  2020-11-11

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Chemical Details

Formal Charge0
Atom Count30
Chiral Atom Count0
Bond Count31
Aromatic Bond Count0
2D diagram of WLG

Chemical Component Summary

Name1-(5-azaspiro[2.5]octan-5-yl)-2-(difluoromethoxy)ethan-1-one
Systematic Name (OpenEye OEToolkits)1-(5-azaspiro[2.5]octan-5-yl)-2-[bis(fluoranyl)methoxy]ethanone
FormulaC10 H15 F2 N O2
Molecular Weight219.228
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01C2CN(CC1(CC1)C2)C(COC(F)F)=O
SMILESCACTVS3.385FC(F)OCC(=O)N1CCCC2(CC2)C1
SMILESOpenEye OEToolkits2.0.7C1CC2(CC2)CN(C1)C(=O)COC(F)F
Canonical SMILESCACTVS3.385 FC(F)OCC(=O)N1CCCC2(CC2)C1
Canonical SMILESOpenEye OEToolkits2.0.7 C1CC2(CC2)CN(C1)C(=O)COC(F)F
InChIInChI1.03 InChI=1S/C10H15F2NO2/c11-9(12)15-6-8(14)13-5-1-2-10(7-13)3-4-10/h9H,1-7H2
InChIKeyInChI1.03 QAUGUVLOVUPMNO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 126769990