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

Systemtic Name: 4-[2-(3-bromanyl-5-chloranyl-2-phenethyloxy-phenyl)ethyl]benzoic acid Openeye Name: 4-[2-(3-bromo-5-chloro-2-phenethyloxy-phenyl)ethyl]benzoic acid CAS Name: 4-[2-(3-bromo-5-chloro-2-phenethyloxyphenyl)ethyl]benzoic acid IUPAC Name: 4-[2-(3-bromo-5-chloro-2-phenethyloxyphenyl)ethyl]benzoic acid Traditional Name: 4-[2-(3-bromo-5-chloro-2-phenethyloxy-phenyl)ethyl]benzoic acid Formula: C23H20BrClO3 MolecularWeight: 459.7601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2CCC3=CC=C(C=C3)C(=O)O)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2CCC3=CC=C(C=C3)C(=O)O)Cl)Br

InChI

InChI=1S/C23H20BrClO3/c24-21-15-20(25)14-19(11-8-17-6-9-18(10-7-17)23(26)27)22(21)28-13-12-16-4-2-1-3-5-16/h1-7,9-10,14-15H,8,11-13H2,(H,26,27)