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CHEBI:104068 - 2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione

ChEBI IDCHEBI:104068
ChEBI Name2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione
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FormulaC30H33N3O4
Net Charge0
Average Mass499.611
Monoisotopic Mass499.24711
SMILESC=CCc1ccccc1OCC(O)CN1CCN(CCN2C(=O)c3cccc4cccc(c34)C2=O)CC1
InChIInChI=1S/C30H33N3O4/c1-2-7-22-8-3-4-13-27(22)37-21-24(34)20-32-16-14-31(15-17-32)18-19-33-29(35)25-11-5-9-23-10-6-12-26(28(23)25)30(33)36/h2-6,8-13,24,34H,1,7,14-21H2
InChIKeyYRMGKUZRKWDWIE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[2-[4-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione (CHEBI:104068) is a isoquinolines (CHEBI:24922)
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