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(Q82917918)
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English
2-[3-(6-Bromo-5-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)propyl]-1H-isoindole-1,3(2H)-dione
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
433.966896644
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₁₂BrClN₂O₄
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canonical SMILES
C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C4=CC(=C(C=C4OC3=O)Br)Cl
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Identifiers
InChI
InChI=1S/C18H12BrClN2O4/c19-12-8-15-14(9-13(12)20)21(18(25)26-15)6-3-7-22-16(23)10-4-1-2-5-11(10)17(22)24/h1-2,4-5,8-9H,3,6-7H2
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InChIKey
JJDFRWUDJCZOMW-UHFFFAOYSA-N
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CAS Registry Number
19420-43-0
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PubChem CID
209184
1 reference
matched by identifier from
InChIKey
InChIKey
JJDFRWUDJCZOMW-UHFFFAOYSA-N
UniChem compound ID
60784116
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90941135
1 reference
matched by identifier from
InChIKey
InChIKey
JJDFRWUDJCZOMW-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401369580
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