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CHEBI:52305 - 7-benzylamino-4-nitrobenz-2-oxa-1,3-diazole

ChEBI IDCHEBI:52305
ChEBI Name7-benzylamino-4-nitrobenz-2-oxa-1,3-diazole
Stars
Last Modified15 April 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC13H10N4O3
Net Charge0
Average Mass270.248
Monoisotopic Mass270.07529
SMILESO=[N+]([O-])c1ccc(NCc2ccccc2)c2nonc12
InChIInChI=1S/C13H10N4O3/c18-17(19)11-7-6-10(12-13(11)16-20-15-12)14-8-9-4-2-1-3-5-9/h1-7,14H,8H2
InChIKeyGZFKJMWBKTUNJS-UHFFFAOYSA-N
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
7-benzylamino-4-nitrobenz-2-oxa-1,3-diazole (CHEBI:52305) has role fluorochrome (CHEBI:51217)
7-benzylamino-4-nitrobenz-2-oxa-1,3-diazole (CHEBI:52305) is a benzoxadiazole (CHEBI:46829)
IUPAC Name 
7-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine
Registry NumbersSources
Beilstein:1148439Beilstein
CAS:18378-20-6ChemIDplus