4-nitro-1,2,5-oxadiazol-3-olate; phenyl(2-phenylethynyl)iodanium

Systemtic Name: 4-nitro-1,2,5-oxadiazol-3-olate; phenyl(2-phenylethynyl)iodanium Openeye Name: 4-nitro-1,2,5-oxadiazol-3-olate; phenyl(2-phenylethynyl)iodonium CAS Name: 4-nitro-1,2,5-oxadiazol-3-olate; phenyl(2-phenylethynyl)iodonium IUPAC Name: 4-nitro-1,2,5-oxadiazol-3-olate; phenyl(2-phenylethynyl)iodanium Traditional Name: 4-nitrofurazan-3-olate; phenyl(2-phenylethynyl)iodonium Formula: C16H10IN3O4 MolecularWeight: 435.17277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#C[I+]C2=CC=CC=C2.C1(=NON=C1[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#C[I+]C2=CC=CC=C2.C1(=NON=C1[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10I.C2HN3O4/c1-3-7-13(8-4-1)11-12-15-14-9-5-2-6-10-14;6-2-1(5(7)8)3-9-4-2/h1-10H;(H,4,6)/q+1;/p-1