(4-butoxycarbonylphenyl) 3-bromanyl-4-ethoxy-benzoate

Systemtic Name: (4-butoxycarbonylphenyl) 3-bromanyl-4-ethoxy-benzoate Openeye Name: (4-butoxycarbonylphenyl) 3-bromo-4-ethoxy-benzoate CAS Name: 3-bromo-4-ethoxybenzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 3-bromo-4-ethoxybenzoate Traditional Name: 3-bromo-4-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=CC(=C(C=C2)OCC)Br

Isomeric SMILES

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

InChI

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