9OX

1,4-oxazepane

Created:2021-11-19
Last modified:  2022-11-30

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Chemical Details

Formal Charge0
Atom Count18
Chiral Atom Count0
Bond Count18
Aromatic Bond Count0
2D diagram of 9OX

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Chemical Component Summary

Name1,4-oxazepane
Systematic Name (OpenEye OEToolkits)1,4-oxazepane
FormulaC5 H11 N O
Molecular Weight101.147
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385C1CNCCOC1
SMILESOpenEye OEToolkits2.0.7C1CNCCOC1
Canonical SMILESCACTVS3.385 C1CNCCOC1
Canonical SMILESOpenEye OEToolkits2.0.7 C1CNCCOC1
InChIInChI1.06 InChI=1S/C5H11NO/c1-2-6-3-5-7-4-1/h6H,1-5H2
InChIKeyInChI1.06 ZNGWEEUXTBNKFR-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 21873275