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CHEBI:108970 - 4-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester

ChEBI IDCHEBI:108970
ChEBI Name4-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester
Stars
DownloadsMolfile
FormulaC15H20N2O5S
Net Charge0
Average Mass340.401
Monoisotopic Mass340.10929
SMILESCOC(=O)c1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)cc1
InChIInChI=1S/C15H20N2O5S/c1-22-15(19)12-3-5-13(6-4-12)16-14(18)11-7-9-17(10-8-11)23(2,20)21/h3-6,11H,7-10H2,1-2H3,(H,16,18)
InChIKeyNUQPBQGXQKBZAJ-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-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester (CHEBI:108970) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-20368LINCS