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(Q82924454)
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English
9-Ethyl-5a,6,8,9,10,11,11a,12-octahydro-5H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizine-8,13-diolato--hydrogen chlorido (1/2)
group of stereoisomers with the chemical formula C₁₉H₂₆Cl₂N₂O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
384.137133432
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆Cl₂N₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCC1C2CC3C4Nc5ccccc5C45CC(C2C5O)N3C1O.Cl.Cl
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC[C@H]1C2C[C@H]3[C@@H]4Nc5ccccc5C45C[C@@H](C2C5O)N3[C@@H]1O.Cl.Cl
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H24N2O2.2ClH/c1-2-9-10-7-13-16-19(11-5-3-4-6-12(11)20-16)8-14(15(10)17(19)22)21(13)18(9)23;;/h3-6,9-10,13-18,20,22-23H,2,7-8H2,1H3;2*1H/t9-,10?,13-,14-,15?,16-,17?,18+,19?;;/m0../s1
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InChIKey
REQPFTKPFURYAG-KNMBSKMQSA-N
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CAS Registry Number
23944-26-5
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PubChem CID
42620254
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
62535727
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70946769
0 references
DSSTOX compound identifier
DTXCID001375044
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