(4-ethanoylphenyl) 3-bromanyl-4-hexoxy-benzoate

Systemtic Name: (4-ethanoylphenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: (4-acetylphenyl) 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid (4-acetylphenyl) ester Formula: C21H23BrO4 MolecularWeight: 419.30892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)C)Br

InChI

InChI=1S/C21H23BrO4/c1-3-4-5-6-13-25-20-12-9-17(14-19(20)22)21(24)26-18-10-7-16(8-11-18)15(2)23/h7-12,14H,3-6,13H2,1-2H3