methyl 4-bromanyl-2,5-ditert-butyl-benzoate

Systemtic Name: methyl 4-bromanyl-2,5-ditert-butyl-benzoate Openeye Name: methyl 4-bromo-2,5-ditert-butyl-benzoate CAS Name: 4-bromo-2,5-ditert-butylbenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2,5-ditert-butylbenzoate Traditional Name: 4-bromo-2,5-ditert-butyl-benzoic acid methyl ester Formula: C16H23BrO2 MolecularWeight: 327.25662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1C(=O)OC)C(C)(C)C)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1C(=O)OC)C(C)(C)C)Br

InChI

InChI=1S/C16H23BrO2/c1-15(2,3)11-9-13(17)12(16(4,5)6)8-10(11)14(18)19-7/h8-9H,1-7H3