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English
SCHEMBL5526808
group of stereoisomers with the chemical formula C₁₂H₁₆N₂O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
220.121177752
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₆N₂O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CN1CC(Cc2ccccc2)NC1C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CN1C[C@H](Cc2ccccc2)NC1C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C12H16N2O2/c1-14-8-10(13-11(14)12(15)16)7-9-5-3-2-4-6-9/h2-6,10-11,13H,7-8H2,1H3,(H,15,16)/t10-,11?/m0/s1
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InChIKey
YAYFGCSJMYVTMF-VUWPPUDQSA-N
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CAS Registry Number
484001-67-4
0 references
PubChem CID
11746147
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
32547482
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50471741
0 references
DSSTOX compound identifier
DTXCID10422557
0 references
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