(2S,6R)-1-(3-ethanoylsulfanylpropanoyl)-6-methyl-piperidine-2-carboxylate

Systemtic Name: (2S,6R)-1-(3-ethanoylsulfanylpropanoyl)-6-methyl-piperidine-2-carboxylate Openeye Name: (2S,6R)-1-(3-acetylsulfanylpropanoyl)-6-methyl-piperidine-2-carboxylate CAS Name: (2S,6R)-1-[3-(acetylthio)-1-oxopropyl]-6-methyl-2-piperidinecarboxylate IUPAC Name: (2S,6R)-1-(3-acetylsulfanylpropanoyl)-6-methylpiperidine-2-carboxylate Traditional Name: (2S,6R)-1-[3-(acetylthio)propanoyl]-6-methyl-pipecolinate Formula: C12H18NO4S- MolecularWeight: 272.34062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CCSC(=O)C)C(=O)[O-]

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CCSC(=O)C)C(=O)[O-]

InChI

InChI=1S/C12H19NO4S/c1-8-4-3-5-10(12(16)17)13(8)11(15)6-7-18-9(2)14/h8,10H,3-7H2,1-2H3,(H,16,17)/p-1/t8-,10+/m1/s1