(2-ethoxy-4-methanoyl-phenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (2-ethoxy-4-methanoyl-phenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (2-ethoxy-4-formyl-phenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (2-ethoxy-4-formylphenyl) ester IUPAC Name: (2-ethoxy-4-formylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2-ethoxy-4-formyl-phenyl) ester Formula: C20H21BrO5 MolecularWeight: 421.28174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=O)OCC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=O)OCC)Br

InChI

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