(2-methyl-1-phenyl-3-sulfonyl-cyclohexyl) methanesulfonate

Systemtic Name: (2-methyl-1-phenyl-3-sulfonyl-cyclohexyl) methanesulfonate Openeye Name: (2-methyl-1-phenyl-3-sulfonyl-cyclohexyl) methanesulfonate CAS Name: methanesulfonic acid (2-methyl-1-phenyl-3-sulfonylcyclohexyl) ester IUPAC Name: (2-methyl-1-phenyl-3-sulfonylcyclohexyl) methanesulfonate Traditional Name: methanesulfonic acid (2-methyl-1-phenyl-3-sulfonyl-cyclohexyl) ester Formula: C14H18O5S2 MolecularWeight: 330.41972

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=S(=O)=O)CCCC1(C2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CC1C(=S(=O)=O)CCCC1(C2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C14H18O5S2/c1-11-13(20(15)16)9-6-10-14(11,19-21(2,17)18)12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3