(4-tert-butyl-2-methyl-phenyl) 2-(2-bromanyl-4-phenyl-phenoxy)ethanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 2-(2-bromanyl-4-phenyl-phenoxy)ethanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 2-(2-bromo-4-phenyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-phenylphenoxy)acetic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 2-(2-bromo-4-phenylphenoxy)acetate Traditional Name: 2-(2-bromo-4-phenyl-phenoxy)acetic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C25H25BrO3 MolecularWeight: 453.3682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)COC2=C(C=C(C=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C25H25BrO3/c1-17-14-20(25(2,3)4)11-13-22(17)29-24(27)16-28-23-12-10-19(15-21(23)26)18-8-6-5-7-9-18/h5-15H,16H2,1-4H3