L9B

4-(4-oxidanylbutyl)benzenesulfonamide

Created:	2019-07-30
Last modified:	2020-08-26

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1 entries where L9B is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	6

2D diagram of L9B

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Chemical Component Summary
Name	4-(4-oxidanylbutyl)benzenesulfonamide
Systematic Name (OpenEye OEToolkits)	4-(4-oxidanylbutyl)benzenesulfonamide
Formula	C₁₀ H₁₅ N O₃ S
Molecular Weight	229.296
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	N[S](=O)(=O)c1ccc(CCCCO)cc1
SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1CCCCO)S(=O)(=O)N
Canonical SMILES	CACTVS	3.385	N[S](=O)(=O)c1ccc(CCCCO)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1CCCCO)S(=O)(=O)N
InChI	InChI	1.03	InChI=1S/C10H15NO3S/c11-15(13,14)10-6-4-9(5-7-10)3-1-2-8-12/h4-7,12H,1-3,8H2,(H2,11,13,14)
InChIKey	InChI	1.03	NCRQTZXHMKBWLU-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL316582
PubChem	15707361
ChEMBL	CHEMBL316582

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.