2-nitro-4-[2,4,6-tris(iodanyl)phenyl]benzoic acid

Systemtic Name: 2-nitro-4-[2,4,6-tris(iodanyl)phenyl]benzoic acid Openeye Name: 2-nitro-4-(2,4,6-triiodophenyl)benzoic acid CAS Name: 2-nitro-4-(2,4,6-triiodophenyl)benzoic acid IUPAC Name: 2-nitro-4-(2,4,6-triiodophenyl)benzoic acid Traditional Name: 2-nitro-4-(2,4,6-triiodophenyl)benzoic acid Formula: C13H6I3NO4 MolecularWeight: 620.90445

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(C=C(C=C2I)I)I)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C2=C(C=C(C=C2I)I)I)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H6I3NO4/c14-7-4-9(15)12(10(16)5-7)6-1-2-8(13(18)19)11(3-6)17(20)21/h1-5H,(H,18,19)