(3-propoxycarbonylphenyl) 3-bromanyl-4-propan-2-yloxy-benzoate

Systemtic Name: (3-propoxycarbonylphenyl) 3-bromanyl-4-propan-2-yloxy-benzoate Openeye Name: (3-propoxycarbonylphenyl) 3-bromo-4-isopropoxy-benzoate CAS Name: 3-bromo-4-propan-2-yloxybenzoic acid [3-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (3-propoxycarbonylphenyl) 3-bromo-4-propan-2-yloxybenzoate Traditional Name: 3-bromo-4-isopropoxy-benzoic acid (3-propoxycarbonylphenyl) ester Formula: C20H21BrO5 MolecularWeight: 421.28174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrO5/c1-4-10-24-19(22)14-6-5-7-16(11-14)26-20(23)15-8-9-18(17(21)12-15)25-13(2)3/h5-9,11-13H,4,10H2,1-3H3