3-[[3,5-bis(azanyl)pyridin-2-yl]diazenyl]-2,4,6-tris(iodanyl)benzoic acid

Systemtic Name: 3-[[3,5-bis(azanyl)pyridin-2-yl]diazenyl]-2,4,6-tris(iodanyl)benzoic acid Openeye Name: 3-[(3,5-diamino-2-pyridyl)azo]-2,4,6-triiodo-benzoic acid CAS Name: 3-[(3,5-diamino-2-pyridinyl)azo]-2,4,6-triiodobenzoic acid IUPAC Name: 3-[(3,5-diaminopyridin-2-yl)diazenyl]-2,4,6-triiodobenzoic acid Traditional Name: 3-[(3,5-diamino-2-pyridyl)azo]-2,4,6-triiodo-benzoic acid Formula: C12H8I3N5O2 MolecularWeight: 634.93763

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1N)N=NC2=C(C=C(C(=C2I)C(=O)O)I)I)N

Isomeric SMILES

C1=C(C=NC(=C1N)N=NC2=C(C=C(C(=C2I)C(=O)O)I)I)N

InChI

InChI=1S/C12H8I3N5O2/c13-5-2-6(14)10(9(15)8(5)12(21)22)19-20-11-7(17)1-4(16)3-18-11/h1-3H,16-17H2,(H,21,22)