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

Systemtic Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-methylsulfonylbenzoate Openeye Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C17H13BrN2O5S MolecularWeight: 437.26452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrN2O5S/c1-26(22,23)14-8-4-12(5-9-14)17(21)24-10-15-19-20-16(25-15)11-2-6-13(18)7-3-11/h2-9H,10H2,1H3