4-Bromo-3-[(2-ethoxyphenoxy)sulfonyl]benzoic acid

ChemSpider ID: 24451769
Molecular Formula: C₁₅H₁₃BrO₆S
Average mass: 401.229095 Da
Monoisotopic mass: 399.961609 Da
Systematic name

4-Bromo-3-[(2-ethoxyphenoxy)sulfonyl]benzoic acid
SMILES and InChIs

SMILES:

CCOc1ccccc1OS(=O)(=O)c2cc(ccc2Br)C(=O)O Copied

Std. InChI:

InChI=1S/C15H13BrO6S/c1-2-21-12-5-3-4-6-13(12)22-23(19,20)14-9-10(15(17)18)7-8-11(14)16/h3-9H,2H2,1H3,(H,17,18) Copied

Std. InChIKey:

KJBXCDZWZRETGD-UHFFFAOYSA-N Copied
Cite this record
CSID:24451769, http://www.chemspider.com/Chemical-Structure.24451769.html (accessed 17:25, May 24, 2013) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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