tert-butyl 4-[4-(bromomethyl)phenyl]-2-propan-2-yloxy-benzoate

Systemtic Name: tert-butyl 4-[4-(bromomethyl)phenyl]-2-propan-2-yloxy-benzoate Openeye Name: tert-butyl 4-[4-(bromomethyl)phenyl]-2-isopropoxy-benzoate CAS Name: 4-[4-(bromomethyl)phenyl]-2-propan-2-yloxybenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(bromomethyl)phenyl]-2-propan-2-yloxybenzoate Traditional Name: 4-[4-(bromomethyl)phenyl]-2-isopropoxy-benzoic acid tert-butyl ester Formula: C21H25BrO3 MolecularWeight: 405.3254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)C2=CC=C(C=C2)CBr)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)C2=CC=C(C=C2)CBr)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H25BrO3/c1-14(2)24-19-12-17(16-8-6-15(13-22)7-9-16)10-11-18(19)20(23)25-21(3,4)5/h6-12,14H,13H2,1-5H3