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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(C(=C(C=C1I)I)OCC(=O)O)I)C(=O)C

Isomeric SMILES

CCCCN(C1=C(C(=C(C=C1I)I)OCC(=O)O)I)C(=O)C

InChI

InChI=1S/C14H16I3NO4/c1-3-4-5-18(8(2)19)13-9(15)6-10(16)14(12(13)17)22-7-11(20)21/h6H,3-5,7H2,1-2H3,(H,20,21)