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CHEBI:64209 - clomipramine(1+)

ChEBI IDCHEBI:64209
ChEBI Nameclomipramine(1+)
Stars
DefinitionAn ammonium ion resulting from the protonation of the dimethyl-substituted amino group of clomipramine.
Last Modified16 March 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC19H24ClN2
Net Charge+1
Average Mass315.868
Monoisotopic Mass315.16225
SMILESC[NH+](C)CCCN1c2ccccc2CCc2ccc(Cl)cc21
InChIInChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3/p+1
InChIKeyGDLIGKIOYRNHDA-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
clomipramine(1+) (CHEBI:64209) is a ammonium ion derivative (CHEBI:35274)
clomipramine(1+) (CHEBI:64209) is a organic cation (CHEBI:25697)
clomipramine(1+) (CHEBI:64209) is conjugate acid of clomipramine (CHEBI:47780)
Incoming Relation(s)
clomipramine hydrochloride (CHEBI:3755) has part clomipramine(1+) (CHEBI:64209)
clomipramine (CHEBI:47780) is conjugate base of clomipramine(1+) (CHEBI:64209)
IUPAC Name 
3-(3-chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-aminium