methyl (2R)-2-acetamido-3-cyclohex-2-en-1-ylsulfanyl-propanoate

Systemtic Name: methyl (2R)-2-acetamido-3-cyclohex-2-en-1-ylsulfanyl-propanoate Openeye Name: methyl (2R)-2-acetamido-3-cyclohex-2-en-1-ylsulfanyl-propanoate CAS Name: (2R)-2-acetamido-3-(1-cyclohex-2-enylthio)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-cyclohex-2-en-1-ylsulfanylpropanoate Traditional Name: (2R)-2-acetamido-3-(cyclohex-2-en-1-ylthio)propionic acid methyl ester Formula: C12H19NO3S MolecularWeight: 257.34916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1CCCC=C1)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CSC1CCCC=C1)C(=O)OC

InChI

InChI=1S/C12H19NO3S/c1-9(14)13-11(12(15)16-2)8-17-10-6-4-3-5-7-10/h4,6,10-11H,3,5,7-8H2,1-2H3,(H,13,14)/t10?,11-/m0/s1