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CHEBI:90126 - N-(p-nitrophenyl)-β-alaninamide

ChEBI IDCHEBI:90126
ChEBI NameN-(p-nitrophenyl)-β-alaninamide
Stars
ASCII NameN-(p-nitrophenyl)-beta-alaninamide
DefinitionA β-alanine derivative that is the amide obtained by formal condensation of the carboxy group of β-alanine with the amino group of 4-nitroaniline.
Last Modified28 October 2015
SubmitterSteve
DownloadsMolfile
FormulaC9H11N3O3
Net Charge0
Average Mass209.205
Monoisotopic Mass209.08004
SMILESNCCC(=O)Nc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C9H11N3O3/c10-6-5-9(13)11-7-1-3-8(4-2-7)12(14)15/h1-4H,5-6,10H2,(H,11,13)
InChIKeyLZZUPCVEJRPUJX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(p-nitrophenyl)-β-alaninamide (CHEBI:90126) has functional parent 4-nitroaniline (CHEBI:17064)
N-(p-nitrophenyl)-β-alaninamide (CHEBI:90126) is a C-nitro compound (CHEBI:35716)
N-(p-nitrophenyl)-β-alaninamide (CHEBI:90126) is a monocarboxylic acid amide (CHEBI:29347)
N-(p-nitrophenyl)-β-alaninamide (CHEBI:90126) is a β-alanine derivative (CHEBI:22823)
IUPAC Name 
N-(4-nitrophenyl)-β-alaninamide
Synonyms  Source
β-alanine 4-nitroanilideChEBI
β-alanine p-nitroanilideChEBI
Registry NumbersSources
Reaxys:4686004Reaxys