CHEBI:107989 - 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid thiophen-2-ylmethyl ester

ChEBI IDCHEBI:107989
ChEBI Name2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid thiophen-2-ylmethyl ester
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FormulaC20H17NO6S2
Net Charge0
Average Mass431.491
Monoisotopic Mass431.04973
SMILESO=C(OCc1cccs1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2
InChIInChI=1S/C20H17NO6S2/c22-20(27-13-14-4-3-11-28-14)16-5-1-2-6-17(16)21-29(23,24)15-7-8-18-19(12-15)26-10-9-25-18/h1-8,11-12,21H,9-10,13H2
InChIKeyHFEGLUYENROKRX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid thiophen-2-ylmethyl ester (CHEBI:107989) is a benzoate ester (CHEBI:36054)
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