methyl 4-(3-methylsulfonyloxycyclohexyl)sulfanylbenzoate

Systemtic Name: methyl 4-(3-methylsulfonyloxycyclohexyl)sulfanylbenzoate Openeye Name: methyl 4-(3-methylsulfonyloxycyclohexyl)sulfanylbenzoate CAS Name: 4-[(3-methylsulfonyloxycyclohexyl)thio]benzoic acid methyl ester IUPAC Name: methyl 4-(3-methylsulfonyloxycyclohexyl)sulfanylbenzoate Traditional Name: 4-[(3-methylsulfonyloxycyclohexyl)thio]benzoic acid methyl ester Formula: C15H20O5S2 MolecularWeight: 344.4463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)SC2CCCC(C2)OS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)SC2CCCC(C2)OS(=O)(=O)C

InChI

InChI=1S/C15H20O5S2/c1-19-15(16)11-6-8-13(9-7-11)21-14-5-3-4-12(10-14)20-22(2,17)18/h6-9,12,14H,3-5,10H2,1-2H3