CHEBI:86569 - 5-acetylamino-2-nitrobenzoic acid

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ChEBI Name 5-acetylamino-2-nitrobenzoic acid ChEBI ID CHEBI:86569 Definition An amidobenzoic acid that is benzoic acid substituted by an acetoamido group at position 5 and a nitro group at position 2 respectively. Stars This entity has been manually annotated by the ChEBI Team. 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 C9H8N2O5 Net Charge 0 Average Mass 224.17020 Monoisotopic Mass 224.04332 InChI InChI=1S/C9H8N2O5/c1-5(12)10-6-2-3-8(11(15)16)7(4-6)9(13)14/h2-4H,1H3,(H,10,12)(H,13,14) InChIKey ZSHFMOUMOUOGKI-UHFFFAOYSA-N SMILES CC(=O)Nc1ccc(c(c1)C(O)=O)[N+]([O-])=O 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 5-acetylamino-2-nitrobenzoic acid (CHEBI:86569) is a C-nitro compound (CHEBI:35716) 5-acetylamino-2-nitrobenzoic acid (CHEBI:86569) is a amidobenzoic acid (CHEBI:48470) IUPAC Name 5-acetamido-2-nitrobenzoic acid Synonym Source 2-nitro-5-acetylaminobenzoic acid ChEBI Registry Numbers Types Sources 2130564 Reaxys Registry Number Reaxys 4368-83-6 CAS Registry Number ChemIDplus Last Modified 21 July 2015