methyl (1S)-2-oxidanylidene-1-[2-(phenylsulfonyl)ethyl]cyclohexane-1-carboxylate

Systemtic Name: methyl (1S)-2-oxidanylidene-1-[2-(phenylsulfonyl)ethyl]cyclohexane-1-carboxylate Openeye Name: methyl (1S)-1-[2-(benzenesulfonyl)ethyl]-2-oxo-cyclohexanecarboxylate CAS Name: (1S)-1-[2-(benzenesulfonyl)ethyl]-2-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S)-1-[2-(benzenesulfonyl)ethyl]-2-oxocyclohexane-1-carboxylate Traditional Name: (1S)-1-(2-besylethyl)-2-keto-cyclohexanecarboxylic acid methyl ester Formula: C16H20O5S MolecularWeight: 324.392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1=O)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@]1(CCCCC1=O)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20O5S/c1-21-15(18)16(10-6-5-9-14(16)17)11-12-22(19,20)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3/t16-/m0/s1