diethyl 2-[[3,5-bis(iodanyl)-4-(4-methoxyphenoxy)phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-[[3,5-bis(iodanyl)-4-(4-methoxyphenoxy)phenyl]methyl]propanedioate Openeye Name: diethyl 2-[[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]methyl]propanedioate CAS Name: 2-[[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3,5-diiodo-4-(4-methoxyphenoxy)phenyl]methyl]propanedioate Traditional Name: 2-[3,5-diiodo-4-(4-methoxyphenoxy)benzyl]malonic acid diethyl ester Formula: C21H22I2O6 MolecularWeight: 624.20472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C(=C1)I)OC2=CC=C(C=C2)OC)I)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C(=C1)I)OC2=CC=C(C=C2)OC)I)C(=O)OCC

InChI

InChI=1S/C21H22I2O6/c1-4-27-20(24)16(21(25)28-5-2)10-13-11-17(22)19(18(23)12-13)29-15-8-6-14(26-3)7-9-15/h6-9,11-12,16H,4-5,10H2,1-3H3