(4-bromanyl-2,6-dimethyl-phenyl) 2-(3,5-dimethylphenoxy)ethanoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 2-(3,5-dimethylphenoxy)ethanoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 2-(3,5-dimethylphenoxy)acetate CAS Name: 2-(3,5-dimethylphenoxy)acetic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 2-(3,5-dimethylphenoxy)acetate Traditional Name: 2-(3,5-dimethylphenoxy)acetic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C18H19BrO3 MolecularWeight: 363.24566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)OC2=C(C=C(C=C2C)Br)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)OC2=C(C=C(C=C2C)Br)C)C

InChI

InChI=1S/C18H19BrO3/c1-11-5-12(2)7-16(6-11)21-10-17(20)22-18-13(3)8-15(19)9-14(18)4/h5-9H,10H2,1-4H3