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CHEBI:93960 - 3-[(3,5-dibromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-methylbenzoic acid

ChEBI IDCHEBI:93960
ChEBI Name3-[(3,5-dibromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-methylbenzoic acid
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DownloadsMolfile
FormulaC15H11Br2NO3
Net Charge0
Average Mass413.065
Monoisotopic Mass410.91057
SMILESCc1c(NC=C2C=C(Br)C=C(Br)C2=O)cccc1C(=O)O
InChIInChI=1S/C15H11Br2NO3/c1-8-11(15(20)21)3-2-4-13(8)18-7-9-5-10(16)6-12(17)14(9)19/h2-7,18H,1H3,(H,20,21)
InChIKeyFEWBBPCEPCJDGY-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-[(3,5-dibromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-methylbenzoic acid (CHEBI:93960) is a aminobenzoic acid (CHEBI:22495)
Manual XrefsDatabases
LSM-4543LINCS