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CHEBI:50738 - 4-carbamoylbenzoic acid

ChEBI IDCHEBI:50738
ChEBI Name4-carbamoylbenzoic acid
Stars
DefinitionA dicarboxylic acid monoamide resulting from the formal condensation of one of the carboxy groups of terephthalic acid with ammonia.
Last Modified16 June 2015
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H7NO3
Net Charge0
Average Mass165.148
Monoisotopic Mass165.04259
SMILESNC(=O)c1ccc(C(=O)O)cc1
InChIInChI=1S/C8H7NO3/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H2,9,10)(H,11,12)
InChIKeyJMHSCWJIDIKGNZ-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)
4-carbamoylbenzoic acid (CHEBI:50738) has functional parent terephthalic acid (CHEBI:15702)
4-carbamoylbenzoic acid (CHEBI:50738) is a carbamoylbenzoic acid (CHEBI:50735)
4-carbamoylbenzoic acid (CHEBI:50738) is a dicarboxylic acid monoamide (CHEBI:35735)
Incoming Relation(s)
tamibarotene (CHEBI:32181) has functional parent 4-carbamoylbenzoic acid (CHEBI:50738)
IUPAC Name 
4-carbamoylbenzoic acid
Synonym  Source
4-(aminocarbonyl)benzoic acidChEBI
Registry NumbersSources
Reaxys:387658Reaxys