[5-(bromomethyl)-2-tert-butyl-phenyl] ethanoate

Systemtic Name: [5-(bromomethyl)-2-tert-butyl-phenyl] ethanoate Openeye Name: [5-(bromomethyl)-2-tert-butyl-phenyl] acetate CAS Name: acetic acid [5-(bromomethyl)-2-tert-butylphenyl] ester IUPAC Name: [5-(bromomethyl)-2-tert-butylphenyl] acetate Traditional Name: acetic acid [5-(bromomethyl)-2-tert-butyl-phenyl] ester Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO2/c1-9(15)16-12-7-10(8-14)5-6-11(12)13(2,3)4/h5-7H,8H2,1-4H3