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(Q82919511)
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English
2-[7-(Diethylamino)-2-oxo-2H-1-benzopyran-3-yl]-5-sulfamoyl-1,3-benzoxazole-7-sulfonic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
493.0613565679999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₉N₃O₈S₂
0 references
canonical SMILES
CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=C(O3)C(=CC(=C4)S(=O)(=O)N)S(=O)(=O)O
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Identifiers
InChI
InChI=1S/C20H19N3O8S2/c1-3-23(4-2)12-6-5-11-7-14(20(24)30-16(11)8-12)19-22-15-9-13(32(21,25)26)10-17(18(15)31-19)33(27,28)29/h5-10H,3-4H2,1-2H3,(H2,21,25,26)(H,27,28,29)
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InChIKey
LSPGGVCFQKDPFI-UHFFFAOYSA-N
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CAS Registry Number
203399-48-8
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PubChem CID
73557376
1 reference
matched by identifier from
InChIKey
InChIKey
LSPGGVCFQKDPFI-UHFFFAOYSA-N
UniChem compound ID
76557826
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40942490
1 reference
matched by identifier from
InChIKey
InChIKey
LSPGGVCFQKDPFI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID201370890
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