CHEBI:105418 - 6-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-[3-(trifluoromethyl)phenyl]benzo[de]isoquinoline-1,3-dione

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ChEBI Name 6-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-[3-(trifluoromethyl)phenyl]benzo[de]isoquinoline-1,3-dione
ChEBI ID CHEBI:105418
Stars This entity has been manually annotated by a third party.
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Formula C31H24F3N3O3
Net Charge 0
Average Mass 543.537
Monoisotopic Mass 543.17698
InChI InChI=1S/C31H24F3N3O3/c32-31(33,34)21-8-4-9-22(18-21)37-29(39)25-11-5-10-23-24(12-13-26(27(23)25)30(37)40)28(38)36-16-14-35(15-17-36)19-20-6-2-1-3-7-20/h1-13,18H,14-17,19H2
InChIKey WLFBEAMGIJRBPQ-UHFFFAOYSA-N
SMILES C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C4C=CC=C5C4=C(C=C3)C(=O)N(C5=O)C6=CC=CC(=C6)C(F)(F)F
ChEBI Ontology
Outgoing 6-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-[3-(trifluoromethyl)phenyl]benzo[de]isoquinoline-1,3-dione (CHEBI:105418) is a naphthalenecarboxamide (CHEBI:48739)
Manual Xref Database
LSM-16781 LINCS
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