methyl 4-(4-butoxyphenoxy)-3,5-bis(iodanyl)benzoate

Systemtic Name: methyl 4-(4-butoxyphenoxy)-3,5-bis(iodanyl)benzoate Openeye Name: methyl 4-(4-butoxyphenoxy)-3,5-diiodo-benzoate CAS Name: 4-(4-butoxyphenoxy)-3,5-diiodobenzoic acid methyl ester IUPAC Name: methyl 4-(4-butoxyphenoxy)-3,5-diiodobenzoate Traditional Name: 4-(4-butoxyphenoxy)-3,5-diiodo-benzoic acid methyl ester Formula: C18H18I2O4 MolecularWeight: 552.14206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OC2=C(C=C(C=C2I)C(=O)OC)I

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OC2=C(C=C(C=C2I)C(=O)OC)I

InChI

InChI=1S/C18H18I2O4/c1-3-4-9-23-13-5-7-14(8-6-13)24-17-15(19)10-12(11-16(17)20)18(21)22-2/h5-8,10-11H,3-4,9H2,1-2H3