(2R)-2-acetamido-3-[(1S,2S)-2-oxidanylcyclohexyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-acetamido-3-[(1S,2S)-2-oxidanylcyclohexyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-acetamido-3-[(1S,2S)-2-hydroxycyclohexyl]sulfanyl-propanoic acid CAS Name: (2R)-2-acetamido-3-[[(1S,2S)-2-hydroxycyclohexyl]thio]propanoic acid IUPAC Name: (2R)-2-acetamido-3-[(1S,2S)-2-hydroxycyclohexyl]sulfanylpropanoic acid Traditional Name: (2R)-2-acetamido-3-[[(1S,2S)-2-hydroxycyclohexyl]thio]propionic acid Formula: C11H19NO4S MolecularWeight: 261.33786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1CCCCC1O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H19NO4S/c1-7(13)12-8(11(15)16)6-17-10-5-3-2-4-9(10)14/h8-10,14H,2-6H2,1H3,(H,12,13)(H,15,16)/t8-,9-,10-/m0/s1