UG8

4-piperidin-1-ylsulfonylbenzaldehyde

Created: 2021-02-16
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count0
Bond Count33
Aromatic Bond Count6
2D diagram of UG8

Chemical Component Summary

Name4-piperidin-1-ylsulfonylbenzaldehyde
Systematic Name (OpenEye OEToolkits)4-piperidin-1-ylsulfonylbenzaldehyde
FormulaC12 H15 N O3 S
Molecular Weight253.317
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385O=Cc1ccc(cc1)[S](=O)(=O)N2CCCCC2
SMILESOpenEye OEToolkits2.0.7c1cc(ccc1C=O)S(=O)(=O)N2CCCCC2
Canonical SMILESCACTVS3.385 O=Cc1ccc(cc1)[S](=O)(=O)N2CCCCC2
Canonical SMILESOpenEye OEToolkits2.0.7 c1cc(ccc1C=O)S(=O)(=O)N2CCCCC2
InChIInChI1.03 InChI=1S/C12H15NO3S/c14-10-11-4-6-12(7-5-11)17(15,16)13-8-2-1-3-9-13/h4-7,10H,1-3,8-9H2
InChIKeyInChI1.03 KUSDDEPOUVZOCG-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 21051090