methyl (2R)-2-acetamido-3-[(1S,2S)-2-acetyloxycyclohexyl]sulfanyl-propanoate

Systemtic Name: methyl (2R)-2-acetamido-3-[(1S,2S)-2-acetyloxycyclohexyl]sulfanyl-propanoate Openeye Name: methyl (2R)-2-acetamido-3-[(1S,2S)-2-acetoxycyclohexyl]sulfanyl-propanoate CAS Name: (2R)-2-acetamido-3-[[(1S,2S)-2-acetyloxycyclohexyl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-[(1S,2S)-2-acetyloxycyclohexyl]sulfanylpropanoate Traditional Name: (2R)-2-acetamido-3-[[(1S,2S)-2-acetoxycyclohexyl]thio]propionic acid methyl ester Formula: C14H23NO5S MolecularWeight: 317.40112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1CCCCC1OC(=O)C)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CS[C@H]1CCCC[C@@H]1OC(=O)C)C(=O)OC

InChI

InChI=1S/C14H23NO5S/c1-9(16)15-11(14(18)19-3)8-21-13-7-5-4-6-12(13)20-10(2)17/h11-13H,4-8H2,1-3H3,(H,15,16)/t11-,12-,13-/m0/s1