(4-bromanyl-2-methoxycarbonyl-phenyl) 3-iodanyl-4-methoxy-benzoate

Systemtic Name: (4-bromanyl-2-methoxycarbonyl-phenyl) 3-iodanyl-4-methoxy-benzoate Openeye Name: (4-bromo-2-methoxycarbonyl-phenyl) 3-iodo-4-methoxy-benzoate CAS Name: 3-iodo-4-methoxybenzoic acid (4-bromo-2-methoxycarbonylphenyl) ester IUPAC Name: (4-bromo-2-methoxycarbonylphenyl) 3-iodo-4-methoxybenzoate Traditional Name: 3-iodo-4-methoxy-benzoic acid (4-bromo-2-carbomethoxy-phenyl) ester Formula: C16H12BrIO5 MolecularWeight: 491.07195

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(=O)OC)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(=O)OC)I

InChI

InChI=1S/C16H12BrIO5/c1-21-14-5-3-9(7-12(14)18)15(19)23-13-6-4-10(17)8-11(13)16(20)22-2/h3-8H,1-2H3