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(Q82068011)
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English
MLS000757093
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
369.000055344
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₁₂BrNO₃
0 references
canonical SMILES
C1OC2=C(O1)C=C(C(=C2)C(=O)NC3=CC=CC4=CC=CC=C43)Br
0 references
Identifiers
InChI
InChI=1S/C18H12BrNO3/c19-14-9-17-16(22-10-23-17)8-13(14)18(21)20-15-7-3-5-11-4-1-2-6-12(11)15/h1-9H,10H2,(H,20,21)
0 references
InChIKey
NHOCPVFXVFBLNN-UHFFFAOYSA-N
0 references
CAS Registry Number
55171-63-6
0 references
PubChem CID
325108
1 reference
matched by identifier from
InChIKey
InChIKey
NHOCPVFXVFBLNN-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL21829027
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NHOCPVFXVFBLNN-UHFFFAOYSA-N
UniChem compound ID
937542
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50315176
1 reference
matched by identifier from
InChIKey
InChIKey
NHOCPVFXVFBLNN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90266299
0 references
NSC number
292923
0 references
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