3-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]butanoic acid

Systemtic Name: 3-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]butanoic acid Openeye Name: 3-[(2,3,5-triiodobenzoyl)amino]butanoic acid CAS Name: 3-[[oxo-(2,3,5-triiodophenyl)methyl]amino]butanoic acid IUPAC Name: 3-[(2,3,5-triiodobenzoyl)amino]butanoic acid Traditional Name: 3-[(2,3,5-triiodobenzoyl)amino]butyric acid Formula: C11H10I3NO3 MolecularWeight: 584.91541

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)C1=CC(=CC(=C1I)I)I

Isomeric SMILES

CC(CC(=O)O)NC(=O)C1=CC(=CC(=C1I)I)I

InChI

InChI=1S/C11H10I3NO3/c1-5(2-9(16)17)15-11(18)7-3-6(12)4-8(13)10(7)14/h3-5H,2H2,1H3,(H,15,18)(H,16,17)