UWQ

4-(4-methoxypiperidin-1-yl)sulfonylbenzaldehyde

Created:	2021-03-24
Last modified:	2024-09-27

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1 entries where UWQ is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	36
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	6

2D diagram of UWQ

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Chemical Component Summary
Name	4-(4-methoxypiperidin-1-yl)sulfonylbenzaldehyde
Systematic Name (OpenEye OEToolkits)	4-(4-methoxypiperidin-1-yl)sulfonylbenzaldehyde
Formula	C₁₃ H₁₇ N O₄ S
Molecular Weight	283.343
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	COC1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2
SMILES	OpenEye OEToolkits	2.0.7	COC1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O
Canonical SMILES	CACTVS	3.385	COC1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2
Canonical SMILES	OpenEye OEToolkits	2.0.7	COC1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O
InChI	InChI	1.03	InChI=1S/C13H17NO4S/c1-18-12-6-8-14(9-7-12)19(16,17)13-4-2-11(10-15)3-5-13/h2-5,10,12H,6-9H2,1H3
InChIKey	InChI	1.03	UXSLYFUIGKMHEK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	155923749

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.