ethyl 2,2-diethyl-3-[2,4,6-tris(iodanyl)phenyl]hexanoate

Systemtic Name: ethyl 2,2-diethyl-3-[2,4,6-tris(iodanyl)phenyl]hexanoate Openeye Name: ethyl 2,2-diethyl-3-(2,4,6-triiodophenyl)hexanoate CAS Name: 2,2-diethyl-3-(2,4,6-triiodophenyl)hexanoic acid ethyl ester IUPAC Name: ethyl 2,2-diethyl-3-(2,4,6-triiodophenyl)hexanoate Traditional Name: 2,2-diethyl-3-(2,4,6-triiodophenyl)hexanoic acid ethyl ester Formula: C18H25I3O2 MolecularWeight: 654.10331

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1I)I)I)C(CC)(CC)C(=O)OCC

Isomeric SMILES

CCCC(C1=C(C=C(C=C1I)I)I)C(CC)(CC)C(=O)OCC

InChI

InChI=1S/C18H25I3O2/c1-5-9-13(16-14(20)10-12(19)11-15(16)21)18(6-2,7-3)17(22)23-8-4/h10-11,13H,5-9H2,1-4H3