2-[[3,5-bis(iodanyl)-2-oxidanyl-phenyl]carbonylamino]-2-cyclopropyl-propanoic acid

Systemtic Name: 2-[[3,5-bis(iodanyl)-2-oxidanyl-phenyl]carbonylamino]-2-cyclopropyl-propanoic acid Openeye Name: 2-cyclopropyl-2-[(2-hydroxy-3,5-diiodo-benzoyl)amino]propanoic acid CAS Name: 2-cyclopropyl-2-[[(2-hydroxy-3,5-diiodophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-cyclopropyl-2-[(2-hydroxy-3,5-diiodobenzoyl)amino]propanoic acid Traditional Name: 2-cyclopropyl-2-[(2-hydroxy-3,5-diiodo-benzoyl)amino]propionic acid Formula: C13H13I2NO4 MolecularWeight: 501.05556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)(C(=O)O)NC(=O)C2=CC(=CC(=C2O)I)I

Isomeric SMILES

CC(C1CC1)(C(=O)O)NC(=O)C2=CC(=CC(=C2O)I)I

InChI

InChI=1S/C13H13I2NO4/c1-13(12(19)20,6-2-3-6)16-11(18)8-4-7(14)5-9(15)10(8)17/h4-6,17H,2-3H2,1H3,(H,16,18)(H,19,20)