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(Q82139849)
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English
STK071891
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
348.2345
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₈BrNO₂
0 references
canonical SMILES
CC(C)C1=CC=C(C=C1)OCC(=O)NC2=CC=CC=C2Br
0 references
Identifiers
InChI
InChI=1S/C17H18BrNO2/c1-12(2)13-7-9-14(10-8-13)21-11-17(20)19-16-6-4-3-5-15(16)18/h3-10,12H,11H2,1-2H3,(H,19,20)
0 references
InChIKey
CRZVJPJGYARLPB-UHFFFAOYSA-N
0 references
CAS Registry Number
431995-26-5
0 references
PubChem CID
924943
1 reference
matched by identifier from
InChIKey
InChIKey
CRZVJPJGYARLPB-UHFFFAOYSA-N
UniChem compound ID
5091730
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30358925
1 reference
matched by identifier from
InChIKey
InChIKey
CRZVJPJGYARLPB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60309980
0 references
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