(4-phenylmethoxyphenyl) 4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: (4-phenylmethoxyphenyl) 4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: (4-benzyloxyphenyl) 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butyric acid (4-benzoxyphenyl) ester Formula: C25H24BrClO4 MolecularWeight: 503.81266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)OC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24BrClO4/c1-17-15-22(24(26)18(2)25(17)27)29-14-6-9-23(28)31-21-12-10-20(11-13-21)30-16-19-7-4-3-5-8-19/h3-5,7-8,10-13,15H,6,9,14,16H2,1-2H3