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CHEBI:94810 - N-[4-oxo-2-(2H-tetrazol-5-yl)-1-benzopyran-8-yl]-4-(4-phenylbutoxy)benzamide

Default Structure
ChEBI IDCHEBI:94810
ChEBI NameN-[4-oxo-2-(2H-tetrazol-5-yl)-1-benzopyran-8-yl]-4-(4-phenylbutoxy)benzamide
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC27H23N5O4
Net Charge0
Average Mass481.512
Monoisotopic Mass481.17500
SMILESO=C(Nc1cccc2c(=O)cc(-c3nnnn3)oc12)c1ccc(OCCCCc2ccccc2)cc1
InChIInChI=1S/C27H23N5O4/c33-23-17-24(26-29-31-32-30-26)36-25-21(23)10-6-11-22(25)28-27(34)19-12-14-20(15-13-19)35-16-5-4-9-18-7-2-1-3-8-18/h1-3,6-8,10-15,17H,4-5,9,16H2,(H,28,34)(H,29,30,31,32)
InChIKeyNBQKINXMPLXUET-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[4-oxo-2-(2H-tetrazol-5-yl)-1-benzopyran-8-yl]-4-(4-phenylbutoxy)benzamide (CHEBI:94810) is a chromones (CHEBI:23238)
Synonyms  Source
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Manual XrefsDatabases
2237DrugCentral
LSM-6006LINCS
Registry NumbersSources
CAS:103177-37-3DrugCentral