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PUBCHEM_71334868
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
377.0454855439999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₁₂ClNO₄
0 references
canonical SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C(=O)OOC(=O)C4=CC(=CC=C4)Cl
0 references
Identifiers
InChI
InChI=1S/C21H12ClNO4/c22-14-7-5-6-13(12-14)20(24)26-27-21(25)19-15-8-1-3-10-17(15)23-18-11-4-2-9-16(18)19/h1-12H
0 references
InChIKey
BRQHESDGSLDBFM-UHFFFAOYSA-N
0 references
CAS Registry Number
109392-91-8
1 reference
InChIKey
BRQHESDGSLDBFM-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=109392-91-8
PubChem CID
71334868
1 reference
matched by identifier from
InChIKey
InChIKey
BRQHESDGSLDBFM-UHFFFAOYSA-N
UniChem compound ID
63035528
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90762928
1 reference
matched by identifier from
InChIKey
InChIKey
BRQHESDGSLDBFM-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30713671
0 references
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