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(Q82658621)
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English
2-[2-(Morpholin-4-yl)-5-nitrobenzene-1-sulfonyl]ethan-1-ol
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
316.07290723200003
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₆N₂O₆S
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canonical SMILES
C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)CCO
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Identifiers
InChI
InChI=1S/C12H16N2O6S/c15-5-8-21(18,19)12-9-10(14(16)17)1-2-11(12)13-3-6-20-7-4-13/h1-2,9,15H,3-8H2
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InChIKey
HGMMHURTNMPKAB-UHFFFAOYSA-N
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CAS Registry Number
105994-40-9
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PubChem CID
57014017
1 reference
matched by identifier from
InChIKey
InChIKey
HGMMHURTNMPKAB-UHFFFAOYSA-N
UniChem compound ID
30280461
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20720051
1 reference
matched by identifier from
InChIKey
InChIKey
HGMMHURTNMPKAB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90670796
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