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(Q82190941)
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English
1-(4-nitrobenzoyl)piperidin-4-one
chemical compound
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instance of
type of chemical entity
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subclass of
chemical compound
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mass
248.079706864
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₂N₂O₄
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canonical SMILES
C1CN(CCC1=O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C12H12N2O4/c15-11-5-7-13(8-6-11)12(16)9-1-3-10(4-2-9)14(17)18/h1-4H,5-8H2
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InChIKey
LQQFSAFLSZJSEH-UHFFFAOYSA-N
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CAS Registry Number
34259-84-2
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PubChem CID
3450714
1 reference
matched by identifier from
InChIKey
InChIKey
LQQFSAFLSZJSEH-UHFFFAOYSA-N
UniChem compound ID
1221353
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10392589
1 reference
matched by identifier from
InChIKey
InChIKey
LQQFSAFLSZJSEH-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10343450
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