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

Systemtic Name: 2-(3-methyl-3-sulfanyl-cyclohexyl)propanoic acid Openeye Name: 2-(3-methyl-3-sulfanyl-cyclohexyl)propanoic acid CAS Name: 2-(3-mercapto-3-methylcyclohexyl)propanoic acid IUPAC Name: 2-(3-methyl-3-sulfanylcyclohexyl)propanoic acid Traditional Name: 2-(3-mercapto-3-methyl-cyclohexyl)propionic acid Formula: C10H18O2S MolecularWeight: 202.31372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCC(C1)(C)S)C(=O)O

Isomeric SMILES

CC(C1CCCC(C1)(C)S)C(=O)O

InChI

InChI=1S/C10H18O2S/c1-7(9(11)12)8-4-3-5-10(2,13)6-8/h7-8,13H,3-6H2,1-2H3,(H,11,12)