(2-bromanyl-4-butan-2-yl-phenyl) 2-(3,5-dimethylphenoxy)ethanoate

Systemtic Name: (2-bromanyl-4-butan-2-yl-phenyl) 2-(3,5-dimethylphenoxy)ethanoate Openeye Name: (2-bromo-4-sec-butyl-phenyl) 2-(3,5-dimethylphenoxy)acetate CAS Name: 2-(3,5-dimethylphenoxy)acetic acid (2-bromo-4-butan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-butan-2-ylphenyl) 2-(3,5-dimethylphenoxy)acetate Traditional Name: 2-(3,5-dimethylphenoxy)acetic acid (2-bromo-4-sec-butyl-phenyl) ester Formula: C20H23BrO3 MolecularWeight: 391.29882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrO3/c1-5-15(4)16-6-7-19(18(21)11-16)24-20(22)12-23-17-9-13(2)8-14(3)10-17/h6-11,15H,5,12H2,1-4H3