(2-bromanyl-4-ethyl-phenyl) 3-bromanyl-4-phenethyloxy-benzoate

Systemtic Name: (2-bromanyl-4-ethyl-phenyl) 3-bromanyl-4-phenethyloxy-benzoate Openeye Name: (2-bromo-4-ethyl-phenyl) 3-bromo-4-phenethyloxy-benzoate CAS Name: 3-bromo-4-phenethyloxybenzoic acid (2-bromo-4-ethylphenyl) ester IUPAC Name: (2-bromo-4-ethylphenyl) 3-bromo-4-phenethyloxybenzoate Traditional Name: 3-bromo-4-phenethyloxy-benzoic acid (2-bromo-4-ethyl-phenyl) ester Formula: C23H20Br2O3 MolecularWeight: 504.2111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br)Br

InChI

InChI=1S/C23H20Br2O3/c1-2-16-8-10-22(19(24)14-16)28-23(26)18-9-11-21(20(25)15-18)27-13-12-17-6-4-3-5-7-17/h3-11,14-15H,2,12-13H2,1H3