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

Systemtic Name: 2-[3-[butanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenoxy]butanoic acid Openeye Name: 2-[3-[butanoyl(ethyl)amino]-2,4,6-triiodo-phenoxy]butanoic acid CAS Name: 2-[3-[ethyl(1-oxobutyl)amino]-2,4,6-triiodophenoxy]butanoic acid IUPAC Name: 2-[3-[butanoyl(ethyl)amino]-2,4,6-triiodophenoxy]butanoic acid Traditional Name: 2-[3-[butyryl(ethyl)amino]-2,4,6-triiodo-phenoxy]butyric acid Formula: C16H20I3NO4 MolecularWeight: 671.04771

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20I3NO4/c1-4-7-12(21)20(6-3)14-9(17)8-10(18)15(13(14)19)24-11(5-2)16(22)23/h8,11H,4-7H2,1-3H3,(H,22,23)