(4-nitro-2-thiophen-2-yl-phenyl) 3-fluoranyl-4-methoxy-benzenesulfonate

Systemtic Name: (4-nitro-2-thiophen-2-yl-phenyl) 3-fluoranyl-4-methoxy-benzenesulfonate Openeye Name: [4-nitro-2-(2-thienyl)phenyl] 3-fluoro-4-methoxy-benzenesulfonate CAS Name: 3-fluoro-4-methoxybenzenesulfonic acid (4-nitro-2-thiophen-2-ylphenyl) ester IUPAC Name: (4-nitro-2-thiophen-2-ylphenyl) 3-fluoro-4-methoxybenzenesulfonate Traditional Name: 3-fluoro-4-methoxy-benzenesulfonic acid [4-nitro-2-(2-thienyl)phenyl] ester Formula: C17H12FNO6S2 MolecularWeight: 409.408683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3)F

InChI

InChI=1S/C17H12FNO6S2/c1-24-16-7-5-12(10-14(16)18)27(22,23)25-15-6-4-11(19(20)21)9-13(15)17-3-2-8-26-17/h2-10H,1H3