[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfonylbenzoate

Systemtic Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfonylbenzoate Openeye Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H13FN2O5S MolecularWeight: 376.358923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H13FN2O5S/c1-26(22,23)14-5-3-2-4-13(14)17(21)24-10-15-19-16(20-25-15)11-6-8-12(18)9-7-11/h2-9H,10H2,1H3