3-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2-methyl-1-piperidinyl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-keto-2-(2-methylpiperidino)ethyl]thio]propionic acid Formula: C11H19NO3S MolecularWeight: 245.33846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSCCC(=O)O

Isomeric SMILES

CC1CCCCN1C(=O)CSCCC(=O)O

InChI

InChI=1S/C11H19NO3S/c1-9-4-2-3-6-12(9)10(13)8-16-7-5-11(14)15/h9H,2-8H2,1H3,(H,14,15)