[(2S)-2-cyclopropyl-2-oxidanyl-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-2-cyclopropyl-2-oxidanyl-ethyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-2-cyclopropyl-2-hydroxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-2-cyclopropyl-2-hydroxyethyl] ester IUPAC Name: [(2S)-2-cyclopropyl-2-hydroxyethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-2-cyclopropyl-2-hydroxy-ethyl] ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2CC2)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C2CC2)O

InChI

InChI=1S/C12H16O4S/c1-9-2-6-11(7-3-9)17(14,15)16-8-12(13)10-4-5-10/h2-3,6-7,10,12-13H,4-5,8H2,1H3/t12-/m1/s1