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CHEBI:61192 - buclizine(2+)

ChEBI IDCHEBI:61192
ChEBI Namebuclizine(2+)
Stars
DefinitionAn ammonium ion that results from the protonation of both of the nitrogens of buclizine.
Last Modified3 February 2011
SubmitterGareth Owen
DownloadsMolfile
FormulaC28H35ClN2
Net Charge+2
Average Mass435.055
Monoisotopic Mass434.24778
SMILESCC(C)(C)c1ccc(C[NH+]2CC[NH+](C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C28H33ClN2/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24/h4-16,27H,17-21H2,1-3H3/p+2
InChIKeyMOYGZHXDRJNJEP-UHFFFAOYSA-P
ChEBI Ontology
Outgoing Relation(s)
buclizine(2+) (CHEBI:61192) is a ammonium ion derivative (CHEBI:35274)
buclizine(2+) (CHEBI:61192) is conjugate acid of buclizine (CHEBI:3205)
Incoming Relation(s)
buclizine dihydrochloride (CHEBI:61193) has part buclizine(2+) (CHEBI:61192)
buclizine (CHEBI:3205) is conjugate base of buclizine(2+) (CHEBI:61192)
IUPAC Name 
1-(4-tert-butylbenzyl)-4-[(4-chlorophenyl)(phenyl)methyl]piperazinediium