(2-bromanyl-4-butan-2-yl-phenyl) 2-(4-phenylphenoxy)butanoate

Systemtic Name: (2-bromanyl-4-butan-2-yl-phenyl) 2-(4-phenylphenoxy)butanoate Openeye Name: (2-bromo-4-sec-butyl-phenyl) 2-(4-phenylphenoxy)butanoate CAS Name: 2-(4-phenylphenoxy)butanoic acid (2-bromo-4-butan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-butan-2-ylphenyl) 2-(4-phenylphenoxy)butanoate Traditional Name: 2-(4-phenylphenoxy)butyric acid (2-bromo-4-sec-butyl-phenyl) ester Formula: C26H27BrO3 MolecularWeight: 467.39478

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OC(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3)Br

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OC(=O)C(CC)OC2=CC=C(C=C2)C3=CC=CC=C3)Br

InChI

InChI=1S/C26H27BrO3/c1-4-18(3)21-13-16-25(23(27)17-21)30-26(28)24(5-2)29-22-14-11-20(12-15-22)19-9-7-6-8-10-19/h6-18,24H,4-5H2,1-3H3