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2-(2-iodanylphenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione

2-(2-iodanylphenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name:2-(2-iodanylphenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione
Openeye Name:2-(2-iodophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-dione
CAS Name:2-(2-iodophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione
IUPAC Name:2-(2-iodophenyl)-6,7-dinitrobenzo[de]isoquinoline-1,3-dione
Traditional Name:2-(2-iodophenyl)-6,7-dinitro-benzo[de]isoquinoline-1,3-quinone
Formula: C18H8IN3O6
MolecularWeight: 489.17709
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)I


Isomeric SMILES

C1=CC=C(C(=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)I


InChI

InChI=1S/C18H8IN3O6/c19-11-3-1-2-4-12(11)20-17(23)9-5-7-13(21(25)26)16-14(22(27)28)8-6-10(15(9)16)18(20)24/h1-8H


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