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CHEBI:107980 - 2-chloro-5-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]benzoic acid methyl ester

ChEBI IDCHEBI:107980
ChEBI Name2-chloro-5-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]benzoic acid methyl ester
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FormulaC17H14ClNO5
Net Charge0
Average Mass347.754
Monoisotopic Mass347.05605
SMILESCOC(=O)c1cc(NC(=O)C2COc3ccccc3O2)ccc1Cl
InChIInChI=1S/C17H14ClNO5/c1-22-17(21)11-8-10(6-7-12(11)18)19-16(20)15-9-23-13-4-2-3-5-14(13)24-15/h2-8,15H,9H2,1H3,(H,19,20)
InChIKeyBWTXGMDTJIHSGE-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)
2-chloro-5-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]benzoic acid methyl ester (CHEBI:107980) is a amidobenzoic acid (CHEBI:48470)
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LSM-19357LINCS