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(Q82833016)
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English
1-(4-Chloro-3-nitrobenzene-1-sulfonyl)-4-(pyridin-2-yl)piperazine
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
382.05025364
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₁₅ClN₄O₄S
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canonical SMILES
C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C15H15ClN4O4S/c16-13-5-4-12(11-14(13)20(21)22)25(23,24)19-9-7-18(8-10-19)15-3-1-2-6-17-15/h1-6,11H,7-10H2
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InChIKey
KBIMMXAODSAVHG-UHFFFAOYSA-N
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CAS Registry Number
920527-52-2
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PubChem CID
71424015
1 reference
matched by identifier from
InChIKey
InChIKey
KBIMMXAODSAVHG-UHFFFAOYSA-N
UniChem compound ID
52016774
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40842820
1 reference
matched by identifier from
InChIKey
InChIKey
KBIMMXAODSAVHG-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60793562
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