2-azanyl-3-[2,5-bis(iodanyl)-1,4-dihydroimidazol-5-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[2,5-bis(iodanyl)-1,4-dihydroimidazol-5-yl]propanoic acid Openeye Name: 2-amino-3-(2,5-diiodo-1,4-dihydroimidazol-5-yl)propanoic acid CAS Name: 2-amino-3-(2,5-diiodo-1,4-dihydroimidazol-5-yl)propanoic acid IUPAC Name: 2-amino-3-(2,5-diiodo-1,4-dihydroimidazol-5-yl)propanoic acid Traditional Name: 2-amino-3-(2,4-diiodo-2-imidazolin-4-yl)propionic acid Formula: C6H9I2N3O2 MolecularWeight: 408.9635

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=N1)I)(CC(C(=O)O)N)I

Isomeric SMILES

C1C(NC(=N1)I)(CC(C(=O)O)N)I

InChI

InChI=1S/C6H9I2N3O2/c7-5-10-2-6(8,11-5)1-3(9)4(12)13/h3H,1-2,9H2,(H,10,11)(H,12,13)