3-fluoranyl-2-(3-methoxycarbonyl-4-nitro-phenoxy)-5-(trifluoromethyl)benzenediazonium tetrafluoroborate

Systemtic Name: 3-fluoranyl-2-(3-methoxycarbonyl-4-nitro-phenoxy)-5-(trifluoromethyl)benzenediazonium tetrafluoroborate Openeye Name: 3-fluoro-2-(3-methoxycarbonyl-4-nitro-phenoxy)-5-(trifluoromethyl)benzenediazonium tetrafluoroborate CAS Name: 3-fluoro-2-(3-methoxycarbonyl-4-nitrophenoxy)-5-(trifluoromethyl)benzenediazonium tetrafluoroborate IUPAC Name: 3-fluoro-2-(3-methoxycarbonyl-4-nitrophenoxy)-5-(trifluoromethyl)benzenediazonium tetrafluoroborate Traditional Name: 2-(3-carbomethoxy-4-nitro-phenoxy)-3-fluoro-5-(trifluoromethyl)benzenediazonium tetrafluoroborate Formula: C15H8BF8N3O5 MolecularWeight: 473.039346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2F)C(F)(F)F)[N+]#N)[N+](=O)[O-]

Isomeric SMILES

[B-](F)(F)(F)F.COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2F)C(F)(F)F)[N+]#N)[N+](=O)[O-]

InChI

InChI=1S/C15H8F4N3O5.BF4/c1-26-14(23)9-6-8(2-3-12(9)22(24)25)27-13-10(16)4-7(15(17,18)19)5-11(13)21-20;2-1(3,4)5/h2-6H,1H3;/q+1;-1