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(Q82152380)
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ZINC02831807
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
234.100442308
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₂H₁₄N₂O₃
0 references
canonical SMILES
CC(=O)/C(=C/c1ccc(N(C)C)cc1)[N+](=O)[O-]
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CC(=O)/C(=C/C1=CC=C(C=C1)N(C)C)/[N+](=O)[O-]
0 references
Identifiers
InChI
InChI=1S/C12H14N2O3/c1-9(15)12(14(16)17)8-10-4-6-11(7-5-10)13(2)3/h4-8H,1-3H3/b12-8-
0 references
InChIKey
NCABOQCGLCVXAA-WQLSENKSSA-N
0 references
CAS Registry Number
5305-86-2
0 references
PubChem CID
2189649
1 reference
matched by identifier from
InChIKey
InChIKey
NCABOQCGLCVXAA-WQLSENKSSA-N
UniChem compound ID
8949180
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70366908
1 reference
matched by identifier from
InChIKey
InChIKey
NCABOQCGLCVXAA-WQLSENKSSA-N
DSSTOX compound identifier
DTXCID80317946
0 references
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