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CHEBI:121759 - 4-bromobenzenesulfonic acid (1,3-dioxo-2-benzo[de]isoquinolinyl) ester

ChEBI IDCHEBI:121759
ChEBI Name4-bromobenzenesulfonic acid (1,3-dioxo-2-benzo[de]isoquinolinyl) ester
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DownloadsMolfile
FormulaC18H10BrNO5S
Net Charge0
Average Mass432.251
Monoisotopic Mass430.94631
SMILESO=C1c2cccc3cccc(c23)C(=O)N1OS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C18H10BrNO5S/c19-12-7-9-13(10-8-12)26(23,24)25-20-17(21)14-5-1-3-11-4-2-6-15(16(11)14)18(20)22/h1-10H
InChIKeyXHVCNNBNWOTBRP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-bromobenzenesulfonic acid (1,3-dioxo-2-benzo[de]isoquinolinyl) ester (CHEBI:121759) is a isoquinolines (CHEBI:24922)
Manual XrefsDatabases
LSM-33202LINCS