(2,6-ditert-butyl-4-methoxy-phenyl) 3-bromanyl-4-methoxy-benzoate

Systemtic Name: (2,6-ditert-butyl-4-methoxy-phenyl) 3-bromanyl-4-methoxy-benzoate Openeye Name: (2,6-ditert-butyl-4-methoxy-phenyl) 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methoxyphenyl) 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid (2,6-ditert-butyl-4-methoxy-phenyl) ester Formula: C23H29BrO4 MolecularWeight: 449.37796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC(=O)C2=CC(=C(C=C2)OC)Br)C(C)(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC(=O)C2=CC(=C(C=C2)OC)Br)C(C)(C)C)OC

InChI

InChI=1S/C23H29BrO4/c1-22(2,3)16-12-15(26-7)13-17(23(4,5)6)20(16)28-21(25)14-9-10-19(27-8)18(24)11-14/h9-13H,1-8H3