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CHEBI:116242 - 4-chloro-3-[[2-(4-methyl-1-piperidinyl)-1-oxoethyl]amino]benzoic acid methyl ester

ChEBI IDCHEBI:116242
ChEBI Name4-chloro-3-[[2-(4-methyl-1-piperidinyl)-1-oxoethyl]amino]benzoic acid methyl ester
Stars
DownloadsMolfile
FormulaC16H21ClN2O3
Net Charge0
Average Mass324.808
Monoisotopic Mass324.12407
SMILESCOC(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C)CC2)c1
InChIInChI=1S/C16H21ClN2O3/c1-11-5-7-19(8-6-11)10-15(20)18-14-9-12(16(21)22-2)3-4-13(14)17/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,20)
InChIKeyVMEHJKKDVHVRQV-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-chloro-3-[[2-(4-methyl-1-piperidinyl)-1-oxoethyl]amino]benzoic acid methyl ester (CHEBI:116242) is a amidobenzoic acid (CHEBI:48470)
Manual XrefsDatabases
LSM-27697LINCS