3-cyclohexyl-2-(2-methyl-3-sulfanyl-propanoyl)oxy-propanoic acid

Systemtic Name: 3-cyclohexyl-2-(2-methyl-3-sulfanyl-propanoyl)oxy-propanoic acid Openeye Name: 3-cyclohexyl-2-(2-methyl-3-sulfanyl-propanoyl)oxy-propanoic acid CAS Name: 3-cyclohexyl-2-(3-mercapto-2-methyl-1-oxopropoxy)propanoic acid IUPAC Name: 3-cyclohexyl-2-(2-methyl-3-sulfanylpropanoyl)oxypropanoic acid Traditional Name: 3-cyclohexyl-2-(3-mercapto-2-methyl-propanoyl)oxy-propionic acid Formula: C13H22O4S MolecularWeight: 274.37638

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)OC(CC1CCCCC1)C(=O)O

Isomeric SMILES

CC(CS)C(=O)OC(CC1CCCCC1)C(=O)O

InChI

InChI=1S/C13H22O4S/c1-9(8-18)13(16)17-11(12(14)15)7-10-5-3-2-4-6-10/h9-11,18H,2-8H2,1H3,(H,14,15)