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(Q83102899)
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English
1-Naphthalenecarbamic acid, 2,2,2-trichloroacetimidoylamino ester
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
344.9838596
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₀Cl₃N₃O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
N=C(NOC(O)=Nc1cccc2ccccc12)C(Cl)(Cl)Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C13H10Cl3N3O2/c14-13(15,16)11(17)19-21-12(20)18-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,(H2,17,19)(H,18,20)
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InChIKey
BXPHIEFYGJEEDS-UHFFFAOYSA-N
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CAS Registry Number
73826-57-0
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PubChem CID
9570819
1 reference
matched by identifier from
InChIKey
InChIKey
BXPHIEFYGJEEDS-UHFFFAOYSA-N
52631
1 reference
matched by identifier from
InChIKey
InChIKey
BXPHIEFYGJEEDS-UHFFFAOYSA-N
5361991
1 reference
matched by identifier from
InChIKey
InChIKey
BXPHIEFYGJEEDS-UHFFFAOYSA-N
DSSTox substance ID
DTXSID40224324
1 reference
matched by identifier from
InChIKey
InChIKey
BXPHIEFYGJEEDS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40146815
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