2-[3-azanyl-2,4,6-tris(iodanyl)phenyl]propanoic acid

Systemtic Name: 2-[3-azanyl-2,4,6-tris(iodanyl)phenyl]propanoic acid Openeye Name: 2-(3-amino-2,4,6-triiodo-phenyl)propanoic acid CAS Name: 2-(3-amino-2,4,6-triiodophenyl)propanoic acid IUPAC Name: 2-(3-amino-2,4,6-triiodophenyl)propanoic acid Traditional Name: 2-(3-amino-2,4,6-triiodo-phenyl)propionic acid Formula: C9H8I3NO2 MolecularWeight: 542.87873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C(C=C1I)I)N)I)C(=O)O

Isomeric SMILES

CC(C1=C(C(=C(C=C1I)I)N)I)C(=O)O

InChI

InChI=1S/C9H8I3NO2/c1-3(9(14)15)6-4(10)2-5(11)8(13)7(6)12/h2-3H,13H2,1H3,(H,14,15)