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(Q82695895)
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English
N-[3-(2-Benzoyl-4-chlorophenyl)-2-oxobutyl]-L-lysinamide
group of stereoisomers with the chemical formula C₂₃H₂₈ClN₃O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
429.181919436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₈ClN₃O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C(=O)CN=C(O)C(N)CCCCN)c1ccc(Cl)cc1C(=O)c1ccccc1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C(=O)CNC(=O)[C@@H](N)CCCCN)c1ccc(Cl)cc1C(=O)c1ccccc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C23H28ClN3O3/c1-15(21(28)14-27-23(30)20(26)9-5-6-12-25)18-11-10-17(24)13-19(18)22(29)16-7-3-2-4-8-16/h2-4,7-8,10-11,13,15,20H,5-6,9,12,14,25-26H2,1H3,(H,27,30)/t15?,20-/m0/s1
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InChIKey
WQRZTXVDPVPVDN-MBABXSBOSA-N
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CAS Registry Number
60067-15-4
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PubChem CID
71313532
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
24449129
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20747061
0 references
DSSTOX compound identifier
DTXCID70697805
0 references
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