(3-phenethyloxycarbonylphenyl) 5-bromanyl-2-propan-2-yloxy-benzoate

Systemtic Name: (3-phenethyloxycarbonylphenyl) 5-bromanyl-2-propan-2-yloxy-benzoate Openeye Name: (3-phenethyloxycarbonylphenyl) 5-bromo-2-isopropoxy-benzoate CAS Name: 5-bromo-2-propan-2-yloxybenzoic acid [3-[oxo(phenethyloxy)methyl]phenyl] ester IUPAC Name: (3-phenethyloxycarbonylphenyl) 5-bromo-2-propan-2-yloxybenzoate Traditional Name: 5-bromo-2-isopropoxy-benzoic acid (3-phenethyloxycarbonylphenyl) ester Formula: C25H23BrO5 MolecularWeight: 483.35112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)C(=O)OC2=CC=CC(=C2)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C25H23BrO5/c1-17(2)30-23-12-11-20(26)16-22(23)25(28)31-21-10-6-9-19(15-21)24(27)29-14-13-18-7-4-3-5-8-18/h3-12,15-17H,13-14H2,1-2H3