3-amino-5-acetamido-2,4,6-triiodobenzoic acid

CAS: 1713-07-1

Formula: C9H7I3N2O3

SMILES: CC(=O)NC1=C(I)C(N)=C(I)C(C(O)=O)=C1I

IUPAC: 3-amino-5-acetamido-2,4,6-triiodobenzoic acid

InChI: InChI=1S/C9H7I3N2O3/c1-2(15)14-8-5(11)3(9(16)17)4(10)7(13)6(8)12/h13H2,1H3,(H,14,15)(H,16,17)

Composition: C (18.90%), H (1.23%), I (66.57%), N (4.90%), O (8.39%)

Molar Mass: 571.879

Atom Count: 24

Heavy Atom Count: 17