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CHEBI:125052 - 4-[4-[(1S,5R)-3-(1-oxo-2-phenylethyl)-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile

ChEBI IDCHEBI:125052
ChEBI Name4-[4-[(1S,5R)-3-(1-oxo-2-phenylethyl)-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile
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FormulaC26H23N3O
Net Charge0
Average Mass393.490
Monoisotopic Mass393.18411
SMILESN#Cc1ccc(-c2ccc(C3[C@@H]4CN(C(=O)Cc5ccccc5)C[C@H]3N4)cc2)cc1
InChIInChI=1S/C26H23N3O/c27-15-19-6-8-20(9-7-19)21-10-12-22(13-11-21)26-23-16-29(17-24(26)28-23)25(30)14-18-4-2-1-3-5-18/h1-13,23-24,26,28H,14,16-17H2/t23-,24+,26?
InChIKeyQYMIRNCPMKEYAE-MAOIWGCQSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[4-[(1S,5R)-3-(1-oxo-2-phenylethyl)-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile (CHEBI:125052) is a biphenyls (CHEBI:22888)
4-[4-[(1S,5R)-3-(1-oxo-2-phenylethyl)-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]benzonitrile (CHEBI:125052) is a nitrile (CHEBI:18379)
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