methyl 4-cyclohexyl-3-methylsulfonyl-benzoate

Systemtic Name: methyl 4-cyclohexyl-3-methylsulfonyl-benzoate Openeye Name: methyl 4-cyclohexyl-3-methylsulfonyl-benzoate CAS Name: 4-cyclohexyl-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-cyclohexyl-3-methylsulfonylbenzoate Traditional Name: 4-cyclohexyl-3-mesyl-benzoic acid methyl ester Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C2CCCCC2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C2CCCCC2)S(=O)(=O)C

InChI

InChI=1S/C15H20O4S/c1-19-15(16)12-8-9-13(11-6-4-3-5-7-11)14(10-12)20(2,17)18/h8-11H,3-7H2,1-2H3