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(Q82749816)
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English
Cyclohexyl 2-(4-nitrobenzene-1-sulfonyl)propanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
341.093308328
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₉NO₆S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C(=O)OC1CCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C15H19NO6S/c1-11(15(17)22-13-5-3-2-4-6-13)23(20,21)14-9-7-12(8-10-14)16(18)19/h7-11,13H,2-6H2,1H3
0 references
InChIKey
JLFSNXWQQFRHLK-UHFFFAOYSA-N
0 references
CAS Registry Number
364044-16-6
0 references
PubChem CID
71360794
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
68668560
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30784563
0 references
DTXSID90877844
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DSSTOX compound identifier
DTXCID60735306
0 references
DTXCID00860186
0 references
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