(4-cyanophenyl)methyl 5-[(2-bromanylphenoxy)methyl]furan-2-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 5-[(2-bromanylphenoxy)methyl]furan-2-carboxylate Openeye Name: (4-cyanophenyl)methyl 5-[(2-bromophenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(2-bromophenoxy)methyl]-2-furancarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 5-[(2-bromophenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(2-bromophenoxy)methyl]furan-2-carboxylic acid (4-cyanobenzyl) ester Formula: C20H14BrNO4 MolecularWeight: 412.23346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC2=CC=C(O2)C(=O)OCC3=CC=C(C=C3)C#N)Br

Isomeric SMILES

C1=CC=C(C(=C1)OCC2=CC=C(O2)C(=O)OCC3=CC=C(C=C3)C#N)Br

InChI

InChI=1S/C20H14BrNO4/c21-17-3-1-2-4-18(17)24-13-16-9-10-19(26-16)20(23)25-12-15-7-5-14(11-22)6-8-15/h1-10H,12-13H2