(phenylmethyl) 4-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoyloxy]benzoate

Systemtic Name: (phenylmethyl) 4-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoyloxy]benzoate Openeye Name: benzyl 4-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoyloxy]benzoate CAS Name: 4-[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxobutoxy]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoyloxy]benzoate Traditional Name: 4-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoyloxy]benzoic acid benzyl ester Formula: C26H24BrClO5 MolecularWeight: 531.82276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24BrClO5/c1-17-15-22(24(27)18(2)25(17)28)31-14-6-9-23(29)33-21-12-10-20(11-13-21)26(30)32-16-19-7-4-3-5-8-19/h3-5,7-8,10-13,15H,6,9,14,16H2,1-2H3