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(Q82516362)
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English
4-(4-Acetamidophenoxy)-3-nitro-5-sulfamoylbenzoic acid
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
395.04233537599987
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₃N₃O₈S
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canonical SMILES
CC(=O)NC1=CC=C(C=C1)OC2=C(C=C(C=C2S(=O)(=O)N)C(=O)O)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C15H13N3O8S/c1-8(19)17-10-2-4-11(5-3-10)26-14-12(18(22)23)6-9(15(20)21)7-13(14)27(16,24)25/h2-7H,1H3,(H,17,19)(H,20,21)(H2,16,24,25)
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InChIKey
UTDYILDFCBUAAX-UHFFFAOYSA-N
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CAS Registry Number
53136-43-9
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PubChem CID
21497789
1 reference
matched by identifier from
InChIKey
InChIKey
UTDYILDFCBUAAX-UHFFFAOYSA-N
UniChem compound ID
26806338
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30614997
1 reference
matched by identifier from
InChIKey
InChIKey
UTDYILDFCBUAAX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70565752
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