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

Systemtic Name: (4-bromanyl-2-propan-2-yl-phenyl) 2-(4-phenylphenoxy)butanoate Openeye Name: (4-bromo-2-isopropyl-phenyl) 2-(4-phenylphenoxy)butanoate CAS Name: 2-(4-phenylphenoxy)butanoic acid (4-bromo-2-propan-2-ylphenyl) ester IUPAC Name: (4-bromo-2-propan-2-ylphenyl) 2-(4-phenylphenoxy)butanoate Traditional Name: 2-(4-phenylphenoxy)butyric acid (4-bromo-2-isopropyl-phenyl) ester Formula: C25H25BrO3 MolecularWeight: 453.3682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=C(C=C(C=C1)Br)C(C)C)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)OC1=C(C=C(C=C1)Br)C(C)C)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

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