[2-methyl-2-[(2S)-oxiran-2-yl]propyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methyl-2-[(2S)-oxiran-2-yl]propyl] 4-methylbenzenesulfonate Openeye Name: [2-methyl-2-[(2S)-oxiran-2-yl]propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methyl-2-[(2S)-2-oxiranyl]propyl] ester IUPAC Name: [2-methyl-2-[(2S)-oxiran-2-yl]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methyl-2-[(2S)-oxiran-2-yl]propyl] ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)C2CO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(C)[C@H]2CO2

InChI

InChI=1S/C13H18O4S/c1-10-4-6-11(7-5-10)18(14,15)17-9-13(2,3)12-8-16-12/h4-7,12H,8-9H2,1-3H3/t12-/m1/s1