(4-butan-2-ylphenyl) 2-(2-bromanyl-4-phenyl-phenoxy)ethanoate

Systemtic Name: (4-butan-2-ylphenyl) 2-(2-bromanyl-4-phenyl-phenoxy)ethanoate Openeye Name: (4-sec-butylphenyl) 2-(2-bromo-4-phenyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-phenylphenoxy)acetic acid (4-butan-2-ylphenyl) ester IUPAC Name: (4-butan-2-ylphenyl) 2-(2-bromo-4-phenylphenoxy)acetate Traditional Name: 2-(2-bromo-4-phenyl-phenoxy)acetic acid (4-sec-butylphenyl) ester Formula: C24H23BrO3 MolecularWeight: 439.34162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrO3/c1-3-17(2)18-9-12-21(13-10-18)28-24(26)16-27-23-14-11-20(15-22(23)25)19-7-5-4-6-8-19/h4-15,17H,3,16H2,1-2H3