(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H14N2O5S MolecularWeight: 358.36846

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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O5S/c1-25(21,22)14-10-6-5-9-13(14)17(20)23-11-15-18-16(19-24-15)12-7-3-2-4-8-12/h2-10H,11H2,1H3