3-[(4-fluorophenyl)methylsulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitro-phenyl]-1,2,4-oxadiazole

Systemtic Name: 3-[(4-fluorophenyl)methylsulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitro-phenyl]-1,2,4-oxadiazole Openeye Name: 3-[(4-fluorophenyl)methylsulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitro-phenyl]-1,2,4-oxadiazole CAS Name: 3-[(4-fluorophenyl)methylsulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitrophenyl]-1,2,4-oxadiazole IUPAC Name: 3-[(4-fluorophenyl)methylsulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitrophenyl]-1,2,4-oxadiazole Traditional Name: 3-[(4-fluorobenzyl)sulfonylmethyl]-5-[2-(4-methoxyphenoxy)-5-nitro-phenyl]-1,2,4-oxadiazole Formula: C23H18FN3O7S MolecularWeight: 499.468323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=NC(=NO3)CS(=O)(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=NC(=NO3)CS(=O)(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H18FN3O7S/c1-32-18-7-9-19(10-8-18)33-21-11-6-17(27(28)29)12-20(21)23-25-22(26-34-23)14-35(30,31)13-15-2-4-16(24)5-3-15/h2-12H,13-14H2,1H3