[(5S)-2-oxidanylidene-3-propan-2-yl-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(5S)-2-oxidanylidene-3-propan-2-yl-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(5S)-3-isopropyl-2-oxo-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(5S)-2-oxo-3-propan-2-yl-5-oxazolidinyl]methyl ester IUPAC Name: [(5S)-2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(5S)-3-isopropyl-2-keto-oxazolidin-5-yl]methyl ester Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CN(C(=O)O2)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2CN(C(=O)O2)C(C)C

InChI

InChI=1S/C14H19NO5S/c1-10(2)15-8-12(20-14(15)16)9-19-21(17,18)13-6-4-11(3)5-7-13/h4-7,10,12H,8-9H2,1-3H3/t12-/m0/s1