(4-propylphenyl) 2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoate

Systemtic Name: (4-propylphenyl) 2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoate Openeye Name: (4-propylphenyl) 2-(4-bromo-2-tert-butyl-phenoxy)acetate CAS Name: 2-(4-bromo-2-tert-butylphenoxy)acetic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 2-(4-bromo-2-tert-butylphenoxy)acetate Traditional Name: 2-(4-bromo-2-tert-butyl-phenoxy)acetic acid (4-propylphenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C21H25BrO3/c1-5-6-15-7-10-17(11-8-15)25-20(23)14-24-19-12-9-16(22)13-18(19)21(2,3)4/h7-13H,5-6,14H2,1-4H3