CHEBI:59175 - bromfenac(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name bromfenac(1−)
ChEBI ID CHEBI:59175
ChEBI ASCII Name bromfenac(1-)
Definition The anion formed by deprotonating bromfenac at the carboxyl proton.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H11BrNO3
Net Charge -1
Average Mass 333.15700
Monoisotopic Mass 331.99278
InChI InChI=1S/C15H12BrNO3/c16-11-6-4-9(5-7-11)15(20)12-3-1-2-10(14(12)17)8-13(18)19/h1-7H,8,17H2,(H,18,19)/p-1
InChIKey ZBPLOVFIXSTCRZ-UHFFFAOYSA-M
SMILES Nc1c(CC([O-])=O)cccc1C(=O)c1ccc(Br)cc1
ChEBI Ontology
Outgoing bromfenac(1−) (CHEBI:59175) is a aromatic amino-acid anion (CHEBI:63473)
bromfenac(1−) (CHEBI:59175) is a benzophenones (CHEBI:22726)
bromfenac(1−) (CHEBI:59175) is a monocarboxylic acid anion (CHEBI:35757)
bromfenac(1−) (CHEBI:59175) is a organobromine compound (CHEBI:37141)
bromfenac(1−) (CHEBI:59175) is conjugate base of bromfenac (CHEBI:240107)
Incoming bromfenac sodium salt (CHEBI:140536) has part bromfenac(1−) (CHEBI:59175)
bromfenac (CHEBI:240107) is conjugate acid of bromfenac(1−) (CHEBI:59175)
IUPAC Name
[2-amino-3-(4-bromobenzoyl)phenyl]acetate
Synonym Source
2-amino-3-(4-bromobenzoyl)benzeneacetate ChEBI
Registry Number Type Source
5977197 Beilstein Registry Number Beilstein
Last Modified
31 January 2012