3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(3,5-dimethylpiperidino)-2-keto-ethyl]thio]propionic acid Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSCCC(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CSCCC(=O)O)C

InChI

InChI=1S/C12H21NO3S/c1-9-5-10(2)7-13(6-9)11(14)8-17-4-3-12(15)16/h9-10H,3-8H2,1-2H3,(H,15,16)