methyl 2-[3,5-bis(bromanyl)-4-(3-iodanyl-4-oxidanyl-phenoxy)phenyl]propanoate

Systemtic Name: methyl 2-[3,5-bis(bromanyl)-4-(3-iodanyl-4-oxidanyl-phenoxy)phenyl]propanoate Openeye Name: methyl 2-[3,5-dibromo-4-(4-hydroxy-3-iodo-phenoxy)phenyl]propanoate CAS Name: 2-[3,5-dibromo-4-(4-hydroxy-3-iodophenoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[3,5-dibromo-4-(4-hydroxy-3-iodophenoxy)phenyl]propanoate Traditional Name: 2-[3,5-dibromo-4-(4-hydroxy-3-iodo-phenoxy)phenyl]propionic acid methyl ester Formula: C16H13Br2IO4 MolecularWeight: 555.98449

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C(=C1)Br)OC2=CC(=C(C=C2)O)I)Br)C(=O)OC

Isomeric SMILES

CC(C1=CC(=C(C(=C1)Br)OC2=CC(=C(C=C2)O)I)Br)C(=O)OC

InChI

InChI=1S/C16H13Br2IO4/c1-8(16(21)22-2)9-5-11(17)15(12(18)6-9)23-10-3-4-14(20)13(19)7-10/h3-8,20H,1-2H3