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CHEBI:78943 - pipamperone(2+)

ChEBI IDCHEBI:78943
ChEBI Namepipamperone(2+)
Stars
DefinitionAn ammonium ion resulting from the protonation of both of the tertiary amino groups of pipamperone.
Last Modified24 June 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC21H32FN3O2
Net Charge+2
Average Mass377.504
Monoisotopic Mass377.24676
SMILESNC(=O)C1([NH+]2CCCCC2)CC[NH+](CCCC(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C21H30FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9H,1-5,10-16H2,(H2,23,27)/p+2
InChIKeyAXKPFOAXAHJUAG-UHFFFAOYSA-P
ChEBI Ontology
Outgoing Relation(s)
pipamperone(2+) (CHEBI:78943) is a ammonium ion derivative (CHEBI:35274)
pipamperone(2+) (CHEBI:78943) is conjugate acid of pipamperone (CHEBI:78549)
Incoming Relation(s)
pipamperone dihydrochloride (CHEBI:32004) has part pipamperone(2+) (CHEBI:78943)
pipamperone (CHEBI:78549) is conjugate base of pipamperone(2+) (CHEBI:78943)
IUPAC Name 
4'-carbamoyl-1'-[4-(4-fluorophenyl)-4-oxobutyl]-1,4'-bipiperidinium