4-[2-[3-bromanyl-5-chloranyl-2-[(2-iodanylphenyl)methoxy]phenyl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3-bromanyl-5-chloranyl-2-[(2-iodanylphenyl)methoxy]phenyl]ethyl]benzoic acid Openeye Name: 4-[2-[3-bromo-5-chloro-2-[(2-iodophenyl)methoxy]phenyl]ethyl]benzoic acid CAS Name: 4-[2-[3-bromo-5-chloro-2-[(2-iodophenyl)methoxy]phenyl]ethyl]benzoic acid IUPAC Name: 4-[2-[3-bromo-5-chloro-2-[(2-iodophenyl)methoxy]phenyl]ethyl]benzoic acid Traditional Name: 4-[2-[3-bromo-5-chloro-2-(2-iodobenzyl)oxy-phenyl]ethyl]benzoic acid Formula: C22H17BrClIO3 MolecularWeight: 571.63005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=C(C=C(C=C2CCC3=CC=C(C=C3)C(=O)O)Cl)Br)I

Isomeric SMILES

C1=CC=C(C(=C1)COC2=C(C=C(C=C2CCC3=CC=C(C=C3)C(=O)O)Cl)Br)I

InChI

InChI=1S/C22H17BrClIO3/c23-19-12-18(24)11-16(10-7-14-5-8-15(9-6-14)22(26)27)21(19)28-13-17-3-1-2-4-20(17)25/h1-6,8-9,11-12H,7,10,13H2,(H,26,27)