[3-(2-bromanylethanoyl)-5-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate

Systemtic Name: [3-(2-bromanylethanoyl)-5-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate Openeye Name: [3-(2-bromoacetyl)-5-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [3-(2-bromo-1-oxoethyl)-5-(3,3-dimethyl-1-oxobutoxy)phenyl] ester IUPAC Name: [3-(2-bromoacetyl)-5-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [3-(2-bromoacetyl)-5-(3,3-dimethylbutanoyloxy)phenyl] ester Formula: C20H27BrO5 MolecularWeight: 427.32938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CC(=CC(=C1)C(=O)CBr)OC(=O)CC(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CC(=CC(=C1)C(=O)CBr)OC(=O)CC(C)(C)C

InChI

InChI=1S/C20H27BrO5/c1-19(2,3)10-17(23)25-14-7-13(16(22)12-21)8-15(9-14)26-18(24)11-20(4,5)6/h7-9H,10-12H2,1-6H3