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(Q76513236)
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English
3-[(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl]-2,2-diphenylpropanenitrile
group of stereoisomers with the chemical formula C₂₄H₂₉N₂⁺
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
345.23252534809
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₄H₂₉N₂⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C[N+]1(C)C2CCC1CC(CC(C#N)(c1ccccc1)c1ccccc1)C2
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[N+]1([C@@H]2CC[C@H]1CC(C2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)C
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Identifiers
InChI
InChI=1S/C24H29N2/c1-26(2)22-13-14-23(26)16-19(15-22)17-24(18-25,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,22-23H,13-17H2,1-2H3/q+1/t19?,22-,23+
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InChIKey
BKLAJZNVMHLXAP-VKGMXUHCSA-N
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PubChem CID
25195533
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UniChem compound ID
65137046
1 reference
stated in
UniChem
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