(4-iodophenyl) 5-bromanyl-2-phenethyloxy-benzoate

Systemtic Name: (4-iodophenyl) 5-bromanyl-2-phenethyloxy-benzoate Openeye Name: (4-iodophenyl) 5-bromo-2-phenethyloxy-benzoate CAS Name: 5-bromo-2-phenethyloxybenzoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 5-bromo-2-phenethyloxybenzoate Traditional Name: 5-bromo-2-phenethyloxy-benzoic acid (4-iodophenyl) ester Formula: C21H16BrIO3 MolecularWeight: 523.15841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)OC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)OC3=CC=C(C=C3)I

InChI

InChI=1S/C21H16BrIO3/c22-16-6-11-20(25-13-12-15-4-2-1-3-5-15)19(14-16)21(24)26-18-9-7-17(23)8-10-18/h1-11,14H,12-13H2