4-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]butanoic acid

Systemtic Name: 4-[[2,3,5-tris(iodanyl)phenyl]carbonylamino]butanoic acid Openeye Name: 4-[(2,3,5-triiodobenzoyl)amino]butanoic acid CAS Name: 4-[[oxo-(2,3,5-triiodophenyl)methyl]amino]butanoic acid IUPAC Name: 4-[(2,3,5-triiodobenzoyl)amino]butanoic acid Traditional Name: 4-[(2,3,5-triiodobenzoyl)amino]butyric acid Formula: C11H10I3NO3 MolecularWeight: 584.91541

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)I)C(=O)NCCCC(=O)O)I

Isomeric SMILES

C1=C(C=C(C(=C1I)I)C(=O)NCCCC(=O)O)I

InChI

InChI=1S/C11H10I3NO3/c12-6-4-7(10(14)8(13)5-6)11(18)15-3-1-2-9(16)17/h4-5H,1-3H2,(H,15,18)(H,16,17)