(2-phenethyloxyphenyl) 5-bromanyl-2-phenethyloxy-benzoate

Systemtic Name: (2-phenethyloxyphenyl) 5-bromanyl-2-phenethyloxy-benzoate Openeye Name: (2-phenethyloxyphenyl) 5-bromo-2-phenethyloxy-benzoate CAS Name: 5-bromo-2-phenethyloxybenzoic acid (2-phenethyloxyphenyl) ester IUPAC Name: (2-phenethyloxyphenyl) 5-bromo-2-phenethyloxybenzoate Traditional Name: 5-bromo-2-phenethyloxy-benzoic acid (2-phenethyloxyphenyl) ester Formula: C29H25BrO4 MolecularWeight: 517.4104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)OC3=CC=CC=C3OCCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)OC3=CC=CC=C3OCCC4=CC=CC=C4

InChI

InChI=1S/C29H25BrO4/c30-24-15-16-26(32-19-17-22-9-3-1-4-10-22)25(21-24)29(31)34-28-14-8-7-13-27(28)33-20-18-23-11-5-2-6-12-23/h1-16,21H,17-20H2