[4-(2-methylpropoxycarbonyl)phenyl] 3-bromanyl-4-(2-methoxyethoxy)benzoate

Systemtic Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-bromanyl-4-(2-methoxyethoxy)benzoate Openeye Name: (4-isobutoxycarbonylphenyl) 3-bromo-4-(2-methoxyethoxy)benzoate CAS Name: 3-bromo-4-(2-methoxyethoxy)benzoic acid [4-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-bromo-4-(2-methoxyethoxy)benzoate Traditional Name: 3-bromo-4-(2-methoxyethoxy)benzoic acid (4-isobutoxycarbonylphenyl) ester Formula: C21H23BrO6 MolecularWeight: 451.30772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCOC)Br

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCOC)Br

InChI

InChI=1S/C21H23BrO6/c1-14(2)13-27-20(23)15-4-7-17(8-5-15)28-21(24)16-6-9-19(18(22)12-16)26-11-10-25-3/h4-9,12,14H,10-11,13H2,1-3H3