[(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-ethylsulfonylbenzoate Openeye Name: [(1R)-1-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] ester IUPAC Name: [(1R)-1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [(1R)-1-[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]ethyl] ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OC(C)C2=NN=C(O2)C3=CC=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)O[C@H](C)C2=NN=C(O2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H20N2O5S/c1-4-28(24,25)17-8-6-5-7-16(17)20(23)26-14(3)18-21-22-19(27-18)15-11-9-13(2)10-12-15/h5-12,14H,4H2,1-3H3/t14-/m1/s1