[2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2,4,6-tris(iodanyl)phenyl]amino]ethyl] 2-ethoxypyridine-3-carboxylate Openeye Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [2-oxo-2-(2,4,6-triiodoanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-triiodoanilino)ethyl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [2-keto-2-(2,4,6-triiodoanilino)ethyl] ester Formula: C16H13I3N2O4 MolecularWeight: 677.99883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NC2=C(C=C(C=C2I)I)I

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NC2=C(C=C(C=C2I)I)I

InChI

InChI=1S/C16H13I3N2O4/c1-2-24-15-10(4-3-5-20-15)16(23)25-8-13(22)21-14-11(18)6-9(17)7-12(14)19/h3-7H,2,8H2,1H3,(H,21,22)