N-(4-iodophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine

Systemtic Name: N-(4-iodophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine Openeye Name: N-(4-iodophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine CAS Name: N-(4-iodophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine IUPAC Name: N-(4-iodophenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine Traditional Name: (5,7-dinitrobenzofurazan-4-yl)-(4-iodophenyl)amine Formula: C12H6IN5O5 MolecularWeight: 427.11101

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-])I

InChI

InChI=1S/C12H6IN5O5/c13-6-1-3-7(4-2-6)14-10-8(17(19)20)5-9(18(21)22)11-12(10)16-23-15-11/h1-5,14H