[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 2-bromanyl-4,5-dimethoxy-benzenesulfonate

Systemtic Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 2-bromanyl-4,5-dimethoxy-benzenesulfonate Openeye Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 2-bromo-4,5-dimethoxy-benzenesulfonate CAS Name: 2-bromo-4,5-dimethoxybenzenesulfonic acid [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] ester IUPAC Name: [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] 2-bromo-4,5-dimethoxybenzenesulfonate Traditional Name: 2-bromo-4,5-dimethoxy-benzenesulfonic acid [4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] ester Formula: C17H15BrN2O6S MolecularWeight: 455.2798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

Isomeric SMILES

CC1=NC(=NO1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

InChI

InChI=1S/C17H15BrN2O6S/c1-10-19-17(20-25-10)11-4-6-12(7-5-11)26-27(21,22)16-9-15(24-3)14(23-2)8-13(16)18/h4-9H,1-3H3