4-[1-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-methoxy-benzoic acid

Systemtic Name: 4-[1-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-methoxy-benzoic acid Openeye Name: 4-[1-(2-benzyloxy-5-bromo-phenyl)ethyl]-2-methoxy-benzoic acid CAS Name: 4-[1-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-methoxybenzoic acid IUPAC Name: 4-[1-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-methoxybenzoic acid Traditional Name: 4-[1-(2-benzoxy-5-bromo-phenyl)ethyl]-2-methoxy-benzoic acid Formula: C23H21BrO4 MolecularWeight: 441.31444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C(=O)O)OC)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(=C(C=C1)C(=O)O)OC)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21BrO4/c1-15(17-8-10-19(23(25)26)22(12-17)27-2)20-13-18(24)9-11-21(20)28-14-16-6-4-3-5-7-16/h3-13,15H,14H2,1-2H3,(H,25,26)