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CHEBI:120618 - 1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid ethyl ester

Default Structure
ChEBI IDCHEBI:120618
ChEBI Name1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC14H19NO3S
Net Charge0
Average Mass281.377
Monoisotopic Mass281.10856
SMILESCCOC(=O)C1CCN(C(=O)Cc2cccs2)CC1
InChIInChI=1S/C14H19NO3S/c1-2-18-14(17)11-5-7-15(8-6-11)13(16)10-12-4-3-9-19-12/h3-4,9,11H,2,5-8,10H2,1H3
InChIKeyYWUSFSDLDXNEKF-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)
1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid ethyl ester (CHEBI:120618) is a carboxylic acid (CHEBI:33575)
1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinecarboxylic acid ethyl ester (CHEBI:120618) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-32060LINCS