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CHEBI:103858 - 1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium

Default Structure
ChEBI IDCHEBI:103858
ChEBI Name1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium
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DownloadsMolfile
FormulaC21H21BrClN2
Net Charge+1
Average Mass416.770
Monoisotopic Mass415.05711
SMILESClc1ccc(-c2c[n+](Cc3ccc(Br)cc3)c3n2CCCCC3)cc1
InChIInChI=1S/C21H21BrClN2/c22-18-9-5-16(6-10-18)14-24-15-20(17-7-11-19(23)12-8-17)25-13-3-1-2-4-21(24)25/h5-12,15H,1-4,13-14H2/q+1
InChIKeyVGTLRNPQZKPXHY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium (CHEBI:103858) is a imidazoles (CHEBI:24780)
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