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(Q82191585)
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English
3-{[4-(2-Methoxyphenoxy)benzene-1-sulfonyl]amino}benzoic 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
399.07765826399987
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₇NO₆S
0 references
canonical SMILES
COC1=CC=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O
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Identifiers
InChI
InChI=1S/C20H17NO6S/c1-26-18-7-2-3-8-19(18)27-16-9-11-17(12-10-16)28(24,25)21-15-6-4-5-14(13-15)20(22)23/h2-13,21H,1H3,(H,22,23)
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InChIKey
KQGHUSZNYWFNEM-UHFFFAOYSA-N
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CAS Registry Number
612044-42-5
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PubChem CID
3492681
1 reference
matched by identifier from
InChIKey
InChIKey
KQGHUSZNYWFNEM-UHFFFAOYSA-N
UniChem compound ID
22815703
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40392996
1 reference
matched by identifier from
InChIKey
InChIKey
KQGHUSZNYWFNEM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90343857
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