2-methoxy-5-methylsulfonyl-cyclohexane-1-carboxylic acid

Systemtic Name: 2-methoxy-5-methylsulfonyl-cyclohexane-1-carboxylic acid Openeye Name: 2-methoxy-5-methylsulfonyl-cyclohexanecarboxylic acid CAS Name: 2-methoxy-5-methylsulfonyl-1-cyclohexanecarboxylic acid IUPAC Name: 2-methoxy-5-methylsulfonylcyclohexane-1-carboxylic acid Traditional Name: 5-mesyl-2-methoxy-cyclohexanecarboxylic acid Formula: C9H16O5S MolecularWeight: 236.28534

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1C(=O)O)S(=O)(=O)C

Isomeric SMILES

COC1CCC(CC1C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C9H16O5S/c1-14-8-4-3-6(15(2,12)13)5-7(8)9(10)11/h6-8H,3-5H2,1-2H3,(H,10,11)