Chemical Compounds of Interest

(Q4895)

Statements

SMILES (without stereochemistry)
CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F
0 references
chemical formula
C₁₁H₁₁F₃N₂O₃
1 reference
based on heuristic
inferred from SMILES
InChI
InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)
1 reference
based on heuristic
inferred from SMILES
AOP-Wiki Stressor ID
137
0 references
 
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