(4-butoxycarbonylphenyl) 5-bromanyl-2-ethoxy-benzoate

Systemtic Name: (4-butoxycarbonylphenyl) 5-bromanyl-2-ethoxy-benzoate Openeye Name: (4-butoxycarbonylphenyl) 5-bromo-2-ethoxy-benzoate CAS Name: 5-bromo-2-ethoxybenzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 5-bromo-2-ethoxybenzoate Traditional Name: 5-bromo-2-ethoxy-benzoic acid (4-butoxycarbonylphenyl) ester Formula: C20H21BrO5 MolecularWeight: 421.28174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C20H21BrO5/c1-3-5-12-25-19(22)14-6-9-16(10-7-14)26-20(23)17-13-15(21)8-11-18(17)24-4-2/h6-11,13H,3-5,12H2,1-2H3