bis[(3-hexyl-4-iodanyl-phenyl)methyl] carbonate

Systemtic Name: bis[(3-hexyl-4-iodanyl-phenyl)methyl] carbonate Openeye Name: bis[(3-hexyl-4-iodo-phenyl)methyl] carbonate CAS Name: carbonic acid bis[(3-hexyl-4-iodophenyl)methyl] ester IUPAC Name: bis[(3-hexyl-4-iodophenyl)methyl] carbonate Traditional Name: carbonic acid bis(3-hexyl-4-iodo-benzyl) ester Formula: C27H36I2O3 MolecularWeight: 662.38188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC(=C1)COC(=O)OCC2=CC(=C(C=C2)I)CCCCCC)I

Isomeric SMILES

CCCCCCC1=C(C=CC(=C1)COC(=O)OCC2=CC(=C(C=C2)I)CCCCCC)I

InChI

InChI=1S/C27H36I2O3/c1-3-5-7-9-11-23-17-21(13-15-25(23)28)19-31-27(30)32-20-22-14-16-26(29)24(18-22)12-10-8-6-4-2/h13-18H,3-12,19-20H2,1-2H3