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

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ChEBI Name 2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid ChEBI ID CHEBI:94985 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H17NO3 Net Charge 0 Average Mass 331.365 Monoisotopic Mass 331.12084 InChI InChI=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) InChIKey PGFQXGLPJUCTOI-UHFFFAOYSA-N SMILES CC(=CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=CC=CC=C3C=C2 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid (CHEBI:94985) is a amidobenzoic acid (CHEBI:48470) Manual Xref Database LSM-6209 LINCS View more database links