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CHEBI:52168 - nile blue(1+)

ChEBI IDCHEBI:52168
ChEBI Namenile blue(1+)
Stars
DefinitionAn organic cation that is 6a,12a-dihydrobenzo[a]phenoxazin-7-ium substituted by amino and dimethylamino groups at positions 5 and 9 respectively. The chloride salt is the histological dye 'nile blue A'
Last Modified25 August 2015
SubmitterInma Spiteri
DownloadsMolfile
FormulaC20H20N3O
Net Charge+1
Average Mass318.400
Monoisotopic Mass318.16009
SMILESCCN(CC)c1ccc2nc3c(cc(N)c4ccccc43)[o+]c2c1
InChIInChI=1S/C20H20N3O/c1-3-23(4-2)13-9-10-17-18(11-13)24-19-12-16(21)14-7-5-6-8-15(14)20(19)22-17/h5-12H,3-4,21H2,1-2H3/q+1
InChIKeyXFQNYSNCQZCISU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
nile blue(1+) (CHEBI:52168) is a organic cation (CHEBI:25697)
Incoming Relation(s)
nile blue A (CHEBI:52163) has part nile blue(1+) (CHEBI:52168)
nile blue perchlorate (CHEBI:52164) has part nile blue(1+) (CHEBI:52168)
IUPAC Name 
5-amino-9-(diethylamino)-6a,12a-dihydrobenzo[a]phenoxazin-7-ium
Synonym  Source
nile blue cationChEBI
Registry NumbersSources
Beilstein:3912711Beilstein