ethyl 3-bromanyl-4-tert-butyl-benzoate

Systemtic Name: ethyl 3-bromanyl-4-tert-butyl-benzoate Openeye Name: ethyl 3-bromo-4-tert-butyl-benzoate CAS Name: 3-bromo-4-tert-butylbenzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-tert-butylbenzoate Traditional Name: 3-bromo-4-tert-butyl-benzoic acid ethyl ester Formula: C13H17BrO2 MolecularWeight: 285.17688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(C)(C)C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(C)(C)C)Br

InChI

InChI=1S/C13H17BrO2/c1-5-16-12(15)9-6-7-10(11(14)8-9)13(2,3)4/h6-8H,5H2,1-4H3