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CHEBI:94985 - 2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid

ChEBI IDCHEBI:94985
ChEBI Name2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid
Stars
DownloadsMolfile
FormulaC21H17NO3
Net Charge0
Average Mass331.371
Monoisotopic Mass331.12084
SMILESCC(=CC(=O)Nc1ccccc1C(=O)O)c1ccc2ccccc2c1
InChIInChI=1S/C21H17NO3/c1-14(16-11-10-15-6-2-3-7-17(15)13-16)12-20(23)22-19-9-5-4-8-18(19)21(24)25/h2-13H,1H3,(H,22,23)(H,24,25)
InChIKeyPGFQXGLPJUCTOI-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid (CHEBI:94985) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-6209LINCS