2-[[3-aminocarbonyl-5-azanyl-2,4,6-tris(iodanyl)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-aminocarbonyl-5-azanyl-2,4,6-tris(iodanyl)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[(3-amino-5-carbamoyl-2,4,6-triiodo-benzoyl)amino]acetic acid CAS Name: 2-[[(3-amino-5-carbamoyl-2,4,6-triiodophenyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3-amino-5-carbamoyl-2,4,6-triiodobenzoyl)amino]acetic acid Traditional Name: 2-[(3-amino-5-carbamoyl-2,4,6-triiodo-benzoyl)amino]acetic acid Formula: C10H8I3N3O4 MolecularWeight: 614.90163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)NC(=O)C1=C(C(=C(C(=C1I)C(=O)N)I)N)I

Isomeric SMILES

C(C(=O)O)NC(=O)C1=C(C(=C(C(=C1I)C(=O)N)I)N)I

InChI

InChI=1S/C10H8I3N3O4/c11-5-3(9(15)19)6(12)8(14)7(13)4(5)10(20)16-1-2(17)18/h1,14H2,(H2,15,19)(H,16,20)(H,17,18)