3-[3-azanyl-2,4,6-tris(iodanyl)phenyl]butanoic acid

Systemtic Name: 3-[3-azanyl-2,4,6-tris(iodanyl)phenyl]butanoic acid Openeye Name: 3-(3-amino-2,4,6-triiodo-phenyl)butanoic acid CAS Name: 3-(3-amino-2,4,6-triiodophenyl)butanoic acid IUPAC Name: 3-(3-amino-2,4,6-triiodophenyl)butanoic acid Traditional Name: 3-(3-amino-2,4,6-triiodo-phenyl)butyric acid Formula: C10H10I3NO2 MolecularWeight: 556.90531

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C1=C(C(=C(C=C1I)I)N)I

Isomeric SMILES

CC(CC(=O)O)C1=C(C(=C(C=C1I)I)N)I

InChI

InChI=1S/C10H10I3NO2/c1-4(2-7(15)16)8-5(11)3-6(12)10(14)9(8)13/h3-4H,2,14H2,1H3,(H,15,16)