phenethyl 3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoyloxy]benzoate

Systemtic Name: phenethyl 3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoyloxy]benzoate Openeye Name: phenethyl 3-[2-(2-bromo-4-ethyl-phenoxy)acetyl]oxybenzoate CAS Name: 3-[2-(2-bromo-4-ethylphenoxy)-1-oxoethoxy]benzoic acid phenethyl ester IUPAC Name: phenethyl 3-[2-(2-bromo-4-ethylphenoxy)acetyl]oxybenzoate Traditional Name: 3-[2-(2-bromo-4-ethyl-phenoxy)acetyl]oxybenzoic acid phenethyl ester Formula: C25H23BrO5 MolecularWeight: 483.35112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C25H23BrO5/c1-2-18-11-12-23(22(26)15-18)30-17-24(27)31-21-10-6-9-20(16-21)25(28)29-14-13-19-7-4-3-5-8-19/h3-12,15-16H,2,13-14,17H2,1H3