CHEBI:109626 - 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester

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ChEBI Name 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester
ChEBI ID CHEBI:109626
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H18N2O9S
Net Charge 0
Average Mass 486.453
Monoisotopic Mass 486.07330
InChI InChI=1S/C22H18N2O9S/c1-32-15-8-6-14(7-9-15)21(26)13-33-22(27)17-4-2-3-5-18(17)23-34(30,31)16-10-11-20(25)19(12-16)24(28)29/h2-12,23,25H,13H2,1H3
InChIKey PWAJCFGQHHRUJH-UHFFFAOYSA-N
SMILES COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]
ChEBI Ontology
Outgoing 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester (CHEBI:109626) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
LSM-21054 LINCS
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