2-azanyl-3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]propanoic acid; 6-azanyl-2-(oxidanylamino)hexanoic acid

Systemtic Name: 2-azanyl-3-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]propanoic acid; 6-azanyl-2-(oxidanylamino)hexanoic acid Openeye Name: 6-amino-2-(hydroxyamino)hexanoic acid; 2-amino-3-(4-hydroxy-3,5-diiodo-phenyl)propanoic acid CAS Name: 6-amino-2-(hydroxyamino)hexanoic acid; 2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid IUPAC Name: 6-amino-2-(hydroxyamino)hexanoic acid; 2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid Traditional Name: 6-amino-2-(hydroxyamino)hexanoic acid; 2-amino-3-(4-hydroxy-3,5-diiodo-phenyl)propionic acid Formula: C15H23I2N3O6 MolecularWeight: 595.16856

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)O)I)CC(C(=O)O)N.C(CCN)CC(C(=O)O)NO

Isomeric SMILES

C1=C(C=C(C(=C1I)O)I)CC(C(=O)O)N.C(CCN)CC(C(=O)O)NO

InChI

InChI=1S/C9H9I2NO3.C6H14N2O3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15;7-4-2-1-3-5(8-11)6(9)10/h1-2,7,13H,3,12H2,(H,14,15);5,8,11H,1-4,7H2,(H,9,10)