2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyl-1,2,3,4-tetrazol-2-ium tetrafluoroborate

Systemtic Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyl-1,2,3,4-tetrazol-2-ium tetrafluoroborate Openeye Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyl-tetrazol-2-ium tetrafluoroborate CAS Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium tetrafluoroborate IUPAC Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium tetrafluoroborate Traditional Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyl-tetrazol-2-ium tetrafluoroborate Formula: C19H13BF4IN5O2 MolecularWeight: 557.047903

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=C(C=C3)I)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=NN([N+](=N2)C3=CC=C(C=C3)I)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13IN5O2.BF4/c20-15-6-8-16(9-7-15)23-21-19(14-4-2-1-3-5-14)22-24(23)17-10-12-18(13-11-17)25(26)27;2-1(3,4)5/h1-13H;/q+1;-1