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CHEBI:145499 - 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one

ChEBI IDCHEBI:145499
ChEBI Name2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one
Stars
DefinitionA member of the class of indanones that is 5,6-dimethoxyindan-1-one which is substituted at position 2 by an (N-benzylpiperidin-4-yl)methyl group.
Last Modified26 November 2019
SubmitterGareth Owen
DownloadsMolfile
FormulaC24H29NO3
Net Charge0
Average Mass379.500
Monoisotopic Mass379.21474
SMILES[H]C1(CC2CCN(Cc3ccccc3)CC2)Cc2cc(OC)c(OC)cc2C1=O
InChIInChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
InChIKeyADEBPBSSDYVVLD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499) is a aromatic ether (CHEBI:35618)
2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499) is a indanones (CHEBI:24789)
2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499) is a piperidines (CHEBI:26151)
Incoming Relation(s)
(R)-donepezil (CHEBI:53292) is a 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499)
(S)-donepezil (CHEBI:53290) is a 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one (CHEBI:145499)
IUPAC Name 
2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one