6-[[(2-iodanylphenyl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(2-iodanylphenyl)amino]methylidene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(2-iodoanilino)methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(2-iodoanilino)methylidene]-2,4-dinitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(2-iodoanilino)methylidene]-2,4-dinitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(2-iodoanilino)methylene]-2,4-dinitro-cyclohexa-2,4-dien-1-one Formula: C13H8IN3O5 MolecularWeight: 413.12419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])[N+](=O)[O-])I

Isomeric SMILES

C1=CC=C(C(=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])[N+](=O)[O-])I

InChI

InChI=1S/C13H8IN3O5/c14-10-3-1-2-4-11(10)15-7-8-5-9(16(19)20)6-12(13(8)18)17(21)22/h1-7,15H