2-[[3,5-bis[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenyl]carbonyl-ethyl-amino]ethanoic acid

Systemtic Name: 2-[[3,5-bis[ethanoyl(ethyl)amino]-2,4,6-tris(iodanyl)phenyl]carbonyl-ethyl-amino]ethanoic acid Openeye Name: 2-[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodo-benzoyl]-ethyl-amino]acetic acid CAS Name: 2-[[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodophenyl]-oxomethyl]-ethylamino]acetic acid IUPAC Name: 2-[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]-ethylamino]acetic acid Traditional Name: 2-[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodo-benzoyl]-ethyl-amino]acetic acid Formula: C19H24I3N3O5 MolecularWeight: 755.12437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24I3N3O5/c1-6-23(9-12(28)29)19(30)13-14(20)17(24(7-2)10(4)26)16(22)18(15(13)21)25(8-3)11(5)27/h6-9H2,1-5H3,(H,28,29)