(3,5-dimethylphenyl) 2-(4-bromanyl-2-methyl-phenoxy)ethanoate

Systemtic Name: (3,5-dimethylphenyl) 2-(4-bromanyl-2-methyl-phenoxy)ethanoate Openeye Name: (3,5-dimethylphenyl) 2-(4-bromo-2-methyl-phenoxy)acetate CAS Name: 2-(4-bromo-2-methylphenoxy)acetic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 2-(4-bromo-2-methylphenoxy)acetate Traditional Name: 2-(4-bromo-2-methyl-phenoxy)acetic acid (3,5-dimethylphenyl) ester Formula: C17H17BrO3 MolecularWeight: 349.21908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)COC2=C(C=C(C=C2)Br)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)COC2=C(C=C(C=C2)Br)C)C

InChI

InChI=1S/C17H17BrO3/c1-11-6-12(2)8-15(7-11)21-17(19)10-20-16-5-4-14(18)9-13(16)3/h4-9H,10H2,1-3H3