(4-phenylmethoxyphenyl) 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: (4-phenylmethoxyphenyl) 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: (4-benzyloxyphenyl) 4-(2-bromo-4-isopropyl-phenoxy)butanoate CAS Name: 4-(2-bromo-4-propan-2-ylphenoxy)butanoic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 4-(2-bromo-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(2-bromo-4-isopropyl-phenoxy)butyric acid (4-benzoxyphenyl) ester Formula: C26H27BrO4 MolecularWeight: 483.39418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C26H27BrO4/c1-19(2)21-10-15-25(24(27)17-21)29-16-6-9-26(28)31-23-13-11-22(12-14-23)30-18-20-7-4-3-5-8-20/h3-5,7-8,10-15,17,19H,6,9,16,18H2,1-2H3