3-azanyl-2,4,6-tris(iodanyl)-5-[methyl(propanoyl)amino]benzoic acid

Systemtic Name: 3-azanyl-2,4,6-tris(iodanyl)-5-[methyl(propanoyl)amino]benzoic acid Openeye Name: 3-amino-2,4,6-triiodo-5-[methyl(propanoyl)amino]benzoic acid CAS Name: 3-amino-2,4,6-triiodo-5-[methyl(1-oxopropyl)amino]benzoic acid IUPAC Name: 3-amino-2,4,6-triiodo-5-[methyl(propanoyl)amino]benzoic acid Traditional Name: 3-amino-2,4,6-triiodo-5-[methyl(propionyl)amino]benzoic acid Formula: C11H11I3N2O3 MolecularWeight: 599.93005

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11I3N2O3/c1-3-4(17)16(2)10-7(13)5(11(18)19)6(12)9(15)8(10)14/h3,15H2,1-2H3,(H,18,19)