[3-(2-methylpropoxycarbonyl)phenyl] 5-bromanyl-2-(2-methoxyethoxy)benzoate

Systemtic Name: [3-(2-methylpropoxycarbonyl)phenyl] 5-bromanyl-2-(2-methoxyethoxy)benzoate Openeye Name: (3-isobutoxycarbonylphenyl) 5-bromo-2-(2-methoxyethoxy)benzoate CAS Name: 5-bromo-2-(2-methoxyethoxy)benzoic acid [3-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [3-(2-methylpropoxycarbonyl)phenyl] 5-bromo-2-(2-methoxyethoxy)benzoate Traditional Name: 5-bromo-2-(2-methoxyethoxy)benzoic acid (3-isobutoxycarbonylphenyl) ester Formula: C21H23BrO6 MolecularWeight: 451.30772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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