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(Q83031462)
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English
4(3H)-Quinazolinone, 6-chloro-3-(3-methyl-5-isoxazolyl)-
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
261.030504176
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₈ClN₃O₂
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canonical SMILES
CC1=NOC(=C1)N2C=NC3=C(C2=O)C=C(C=C3)Cl
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Identifiers
InChI
InChI=1S/C12H8ClN3O2/c1-7-4-11(18-15-7)16-6-14-10-3-2-8(13)5-9(10)12(16)17/h2-6H,1H3
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InChIKey
PXNBZIOAOHXQIM-UHFFFAOYSA-N
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CAS Registry Number
144485-82-5
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PubChem CID
63335
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UniChem compound ID
67486177
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00162718
1 reference
matched by identifier from
InChIKey
InChIKey
PXNBZIOAOHXQIM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID9085209
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