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(Q76512545)
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English
[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 1H-pyrrolo[2,3-b]pyridine-3-carboxylate
group of stereoisomers with the chemical formula C₁₆H₁₉N₃O₂
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
285.14772684800005
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₆H₁₉N₃O₂
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canonical SMILES
CN1C2CCC1CC(OC(=O)c1c[nH]c3ncccc13)C2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CNC4=C3C=CC=N4
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Identifiers
InChI
InChI=1S/C16H19N3O2/c1-19-10-4-5-11(19)8-12(7-10)21-16(20)14-9-18-15-13(14)3-2-6-17-15/h2-3,6,9-12H,4-5,7-8H2,1H3,(H,17,18)/t10-,11+,12?
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InChIKey
WQGFCATXRXQKNB-FOSCPWQOSA-N
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PubChem CID
24752838
0 references
UniChem compound ID
655115
1 reference
stated in
UniChem
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