QTD

4-phenoxybenzene-1-sulfonamide

Created:	2019-12-18
Last modified:	2020-08-26

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1 entries where QTD is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	29
Aromatic Bond Count	12

2D diagram of QTD

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Chemical Component Summary
Name	4-phenoxybenzene-1-sulfonamide
Systematic Name (OpenEye OEToolkits)	4-phenoxybenzenesulfonamide
Formula	C₁₂ H₁₁ N O₃ S
Molecular Weight	249.286
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c2(Oc1ccc(S(N)(=O)=O)cc1)ccccc2
SMILES	CACTVS	3.385	N[S](=O)(=O)c1ccc(Oc2ccccc2)cc1
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Oc2ccc(cc2)S(=O)(=O)N
Canonical SMILES	CACTVS	3.385	N[S](=O)(=O)c1ccc(Oc2ccccc2)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Oc2ccc(cc2)S(=O)(=O)N
InChI	InChI	1.03	InChI=1S/C12H11NO3S/c13-17(14,15)12-8-6-11(7-9-12)16-10-4-2-1-3-5-10/h1-9H,(H2,13,14,15)
InChIKey	InChI	1.03	JVMQLNXAPHLKDV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	838564

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