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

Systemtic Name: 2-[3-[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]butanoic acid Openeye Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]butanoic acid CAS Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]butanoic acid IUPAC Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodophenoxy]butanoic acid Traditional Name: 2-[3-[acetyl(ethyl)amino]-2,4,6-triiodo-phenoxy]butyric acid Formula: C14H16I3NO4 MolecularWeight: 642.99455

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=C(C=C(C(=C1I)N(CC)C(=O)C)I)I

Isomeric SMILES

CCC(C(=O)O)OC1=C(C=C(C(=C1I)N(CC)C(=O)C)I)I

InChI

InChI=1S/C14H16I3NO4/c1-4-10(14(20)21)22-13-9(16)6-8(15)12(11(13)17)18(5-2)7(3)19/h6,10H,4-5H2,1-3H3,(H,20,21)