2-(5-azanyl-2-iodanyl-4-nitro-phenyl)-2-cyano-ethanoic acid

Systemtic Name: 2-(5-azanyl-2-iodanyl-4-nitro-phenyl)-2-cyano-ethanoic acid Openeye Name: 2-(5-amino-2-iodo-4-nitro-phenyl)-2-cyano-acetic acid CAS Name: 2-(5-amino-2-iodo-4-nitrophenyl)-2-cyanoacetic acid IUPAC Name: 2-(5-amino-2-iodo-4-nitrophenyl)-2-cyanoacetic acid Traditional Name: 2-(5-amino-2-iodo-4-nitro-phenyl)-2-cyano-acetic acid Formula: C9H6IN3O4 MolecularWeight: 347.06611

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)[N+](=O)[O-])I)C(C#N)C(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1N)[N+](=O)[O-])I)C(C#N)C(=O)O

InChI

InChI=1S/C9H6IN3O4/c10-6-2-8(13(16)17)7(12)1-4(6)5(3-11)9(14)15/h1-2,5H,12H2,(H,14,15)