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CHEBI:52728 - ethyl nile blue(1+)

ChEBI IDCHEBI:52728
ChEBI Nameethyl nile blue(1+)
Stars
DefinitionThe cation of ethyl nile blue.
Last Modified10 July 2009
SubmitterSteve
DownloadsMolfile
FormulaC22H24N3O
Net Charge+1
Average Mass346.454
Monoisotopic Mass346.19139
SMILESCCNc1cc2[o+]c3cc(N(CC)CC)ccc3nc2c2ccccc12
InChIInChI=1S/C22H24N3O/c1-4-23-19-14-21-22(17-10-8-7-9-16(17)19)24-18-12-11-15(13-20(18)26-21)25(5-2)6-3/h7-14,23H,4-6H2,1-3H3/q+1
InChIKeyNPEBOQVOGKJLLV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ethyl nile blue(1+) (CHEBI:52728) is a organic cation (CHEBI:25697)
ethyl nile blue(1+) (CHEBI:52728) is a organic heterotetracyclic compound (CHEBI:38163)
Incoming Relation(s)
ethyl nile blue A (CHEBI:52727) has part ethyl nile blue(1+) (CHEBI:52728)
IUPAC Name 
9-(diethylamino)-5-(ethylamino)benzo[a]phenoxazin-7-ium