(4-methylphenyl) 1-methylthiolane-1-sulfonate

Systemtic Name: (4-methylphenyl) 1-methylthiolane-1-sulfonate Openeye Name: p-tolyl 1-methylthiolane-1-sulfonate CAS Name: 1-methyl-1-thiolanesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 1-methylthiolane-1-sulfonate Traditional Name: 1-methylthiolane-1-sulfonic acid p-tolyl ester Formula: C12H18O3S2 MolecularWeight: 274.39952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)S2(CCCC2)C

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)S2(CCCC2)C

InChI

InChI=1S/C12H18O3S2/c1-11-5-7-12(8-6-11)15-17(13,14)16(2)9-3-4-10-16/h5-8H,3-4,9-10H2,1-2H3