(3-propanoyloxyphenyl) propanoate tetraiodide tetrahydrate

Systemtic Name: (3-propanoyloxyphenyl) propanoate tetraiodide tetrahydrate Openeye Name: (3-propanoyloxyphenyl) propanoate tetraiodide tetrahydrate CAS Name: propanoic acid [3-(1-oxopropoxy)phenyl] ester tetraiodide tetrahydrate IUPAC Name: (3-propanoyloxyphenyl) propanoate tetraiodide tetrahydrate Traditional Name: propionic acid (3-propionyloxyphenyl) ester tetraiodide tetrahydrate Formula: C12H22I4O8-4 MolecularWeight: 801.91616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC(=CC=C1)OC(=O)CC.O.O.O.O.[I-].[I-].[I-].[I-]

Isomeric SMILES

CCC(=O)OC1=CC(=CC=C1)OC(=O)CC.O.O.O.O.[I-].[I-].[I-].[I-]

InChI

InChI=1S/C12H14O4.4HI.4H2O/c1-3-11(13)15-9-6-5-7-10(8-9)16-12(14)4-2;;;;;;;;/h5-8H,3-4H2,1-2H3;4*1H;4*1H2/p-4