(4-cyano-2-iodanyl-6-nitro-phenyl) ethanoate

Systemtic Name: (4-cyano-2-iodanyl-6-nitro-phenyl) ethanoate Openeye Name: (4-cyano-2-iodo-6-nitro-phenyl) acetate CAS Name: acetic acid (4-cyano-2-iodo-6-nitrophenyl) ester IUPAC Name: (4-cyano-2-iodo-6-nitrophenyl) acetate Traditional Name: acetic acid (4-cyano-2-iodo-6-nitro-phenyl) ester Formula: C9H5IN2O4 MolecularWeight: 332.05147

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1I)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1I)C#N)[N+](=O)[O-]

InChI

InChI=1S/C9H5IN2O4/c1-5(13)16-9-7(10)2-6(4-11)3-8(9)12(14)15/h2-3H,1H3