CHEBI:109021 - [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[5-[(4-chlorophenoxy)methyl]-2-furanyl]methanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[5-[(4-chlorophenoxy)methyl]-2-furanyl]methanone
ChEBI ID CHEBI:109021
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H23ClN2O5
Net Charge 0
Average Mass 454.904
Monoisotopic Mass 454.12955
InChI InChI=1S/C24H23ClN2O5/c25-18-2-4-19(5-3-18)29-15-20-6-8-22(32-20)24(28)27-11-9-26(10-12-27)14-17-1-7-21-23(13-17)31-16-30-21/h1-8,13H,9-12,14-16H2
InChIKey VLGIHPDIKKJWQT-UHFFFAOYSA-N
SMILES C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(O4)COC5=CC=C(C=C5)Cl
ChEBI Ontology
Outgoing [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[5-[(4-chlorophenoxy)methyl]-2-furanyl]methanone (CHEBI:109021) is a benzodioxoles (CHEBI:38298)
Manual Xref Database
LSM-20419 LINCS
View more database links