1-[4-(1-iodanylpropylamino)-3,5-dinitro-phenyl]ethanone

Systemtic Name: 1-[4-(1-iodanylpropylamino)-3,5-dinitro-phenyl]ethanone Openeye Name: 1-[4-(1-iodopropylamino)-3,5-dinitro-phenyl]ethanone CAS Name: 1-[4-(1-iodopropylamino)-3,5-dinitrophenyl]ethanone IUPAC Name: 1-[4-(1-iodopropylamino)-3,5-dinitrophenyl]ethanone Traditional Name: 1-[4-(1-iodopropylamino)-3,5-dinitro-phenyl]ethanone Formula: C11H12IN3O5 MolecularWeight: 393.13455

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1=C(C=C(C=C1[N+](=O)[O-])C(=O)C)[N+](=O)[O-])I

Isomeric SMILES

CCC(NC1=C(C=C(C=C1[N+](=O)[O-])C(=O)C)[N+](=O)[O-])I

InChI

InChI=1S/C11H12IN3O5/c1-3-10(12)13-11-8(14(17)18)4-7(6(2)16)5-9(11)15(19)20/h4-5,10,13H,3H2,1-2H3