[2-(4-bromophenyl)sulfanylcyclohexyl] methanesulfonate

Systemtic Name: [2-(4-bromophenyl)sulfanylcyclohexyl] methanesulfonate Openeye Name: [2-(4-bromophenyl)sulfanylcyclohexyl] methanesulfonate CAS Name: methanesulfonic acid [2-[(4-bromophenyl)thio]cyclohexyl] ester IUPAC Name: [2-(4-bromophenyl)sulfanylcyclohexyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[(4-bromophenyl)thio]cyclohexyl] ester Formula: C13H17BrO3S2 MolecularWeight: 365.30628

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCCCC1SC2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)OC1CCCCC1SC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H17BrO3S2/c1-19(15,16)17-12-4-2-3-5-13(12)18-11-8-6-10(14)7-9-11/h6-9,12-13H,2-5H2,1H3