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(Q82682875)
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English
Ethyl 1-(benzenesulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
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
330.067427928
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₄N₂O₄S
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canonical SMILES
CCOC(=O)C1=CC2=C(N1S(=O)(=O)C3=CC=CC=C3)N=CC=C2
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Identifiers
InChI
InChI=1S/C16H14N2O4S/c1-2-22-16(19)14-11-12-7-6-10-17-15(12)18(14)23(20,21)13-8-4-3-5-9-13/h3-11H,2H2,1H3
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InChIKey
BRSSBYOXGZEQBP-UHFFFAOYSA-N
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CAS Registry Number
146603-30-7
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PubChem CID
68005565
1 reference
matched by identifier from
InChIKey
InChIKey
BRSSBYOXGZEQBP-UHFFFAOYSA-N
UniChem compound ID
28479539
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60737885
1 reference
matched by identifier from
InChIKey
InChIKey
BRSSBYOXGZEQBP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40688629
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