(4-bromanyl-2,6-dimethyl-phenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 4-(4-chloranyl-3,5-dimethyl-phenoxy)butanoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 4-(4-chloro-3,5-dimethyl-phenoxy)butanoate CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)butanoic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 4-(4-chloro-3,5-dimethylphenoxy)butanoate Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)butyric acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C20H22BrClO3 MolecularWeight: 425.74388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C20H22BrClO3/c1-12-10-17(11-13(2)19(12)22)24-7-5-6-18(23)25-20-14(3)8-16(21)9-15(20)4/h8-11H,5-7H2,1-4H3