2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenyl]propanoic acid

Systemtic Name: 2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenyl]propanoic acid Openeye Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenyl]propanoic acid CAS Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenyl]propanoic acid IUPAC Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenyl]propanoic acid Traditional Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenyl]propionic acid Formula: C13H14I3NO3 MolecularWeight: 612.96857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14I3NO3/c1-4-17(7(3)18)12-9(15)5-8(14)10(11(12)16)6(2)13(19)20/h5-6H,4H2,1-3H3,(H,19,20)