3-azanyl-5-(diethanoylamino)-2,4,6-tris(iodanyl)benzoic acid

Systemtic Name: 3-azanyl-5-(diethanoylamino)-2,4,6-tris(iodanyl)benzoic acid Openeye Name: 3-amino-5-(diacetylamino)-2,4,6-triiodo-benzoic acid CAS Name: 3-amino-5-(diacetylamino)-2,4,6-triiodobenzoic acid IUPAC Name: 3-amino-5-(diacetylamino)-2,4,6-triiodobenzoic acid Traditional Name: 3-amino-5-(diacetylamino)-2,4,6-triiodo-benzoic acid Formula: C11H9I3N2O4 MolecularWeight: 613.91357

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9I3N2O4/c1-3(17)16(4(2)18)10-7(13)5(11(19)20)6(12)9(15)8(10)14/h15H2,1-2H3,(H,19,20)