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Revision as of 17:07, 1 August 2024 by
Egonw
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#quickstatements; #temporary_batch_1722531995718)
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Statements
instance of
type of a chemical entity
0 references
SMILES (without stereochemistry)
C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC=C(C=C2)Cl)F
0 references
chemical formula
C₁₄H₉ClF₂N₂O₂
1 reference
based on heuristic
inferred from SMILES
mass
310.6837
1 reference
based on heuristic
inferred from SMILES
InChI
InChI=1S/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)
1 reference
based on heuristic
inferred from SMILES
InChIKey
QQQYTWIFVNKMRW-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from SMILES
PubChem CID
37123
1 reference
based on heuristic
inferred from InChIKey
AOP-Wiki Stressor ID
371
0 references