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(Q82176900)
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English
3-(5-Methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic 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
221.068807832
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₁NO₄
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canonical SMILES
CC1=CC2=C(C=C1)OC(=O)N2CCC(=O)O
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Identifiers
InChI
InChI=1S/C11H11NO4/c1-7-2-3-9-8(6-7)12(11(15)16-9)5-4-10(13)14/h2-3,6H,4-5H2,1H3,(H,13,14)
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InChIKey
FTSJMZOSLSBKME-UHFFFAOYSA-N
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CAS Registry Number
71977-76-9
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PubChem CID
2813389
1 reference
matched by identifier from
InChIKey
InChIKey
FTSJMZOSLSBKME-UHFFFAOYSA-N
UniChem compound ID
23037690
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60384631
1 reference
matched by identifier from
InChIKey
InChIKey
FTSJMZOSLSBKME-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30335655
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