3,4,5-tris(iodanyl)-N-(2,4,6-trinitrophenyl)aniline

Systemtic Name: 3,4,5-tris(iodanyl)-N-(2,4,6-trinitrophenyl)aniline Openeye Name: 3,4,5-triiodo-N-(2,4,6-trinitrophenyl)aniline CAS Name: 3,4,5-triiodo-N-(2,4,6-trinitrophenyl)aniline IUPAC Name: 3,4,5-triiodo-N-(2,4,6-trinitrophenyl)aniline Traditional Name: picryl-(3,4,5-triiodophenyl)amine Formula: C12H5I3N4O6 MolecularWeight: 681.90471

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)I)I)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1I)I)I)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H5I3N4O6/c13-7-1-5(2-8(14)11(7)15)16-12-9(18(22)23)3-6(17(20)21)4-10(12)19(24)25/h1-4,16H