CHEBI:109621 - 3-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]butanoic acid

ChEBI IDCHEBI:109621
ChEBI Name3-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]butanoic acid
Stars
DownloadsMolfile
FormulaC18H28N2O4S
Net Charge0
Average Mass368.499
Monoisotopic Mass368.17698
SMILESCCC(C)c1ccc(S(=O)(=O)N2CCN(C(C)CC(=O)O)CC2)cc1
InChIInChI=1S/C18H28N2O4S/c1-4-14(2)16-5-7-17(8-6-16)25(23,24)20-11-9-19(10-12-20)15(3)13-18(21)22/h5-8,14-15H,4,9-13H2,1-3H3,(H,21,22)
InChIKeyLGMCGWLSDVQJAE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]butanoic acid (CHEBI:109621) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-21049LINCS