(3-cyanophenyl)methyl 5-(4-ethanoylphenyl)furan-2-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: (3-cyanophenyl)methyl 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid (3-cyanobenzyl) ester Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H15NO4/c1-14(23)17-5-7-18(8-6-17)19-9-10-20(26-19)21(24)25-13-16-4-2-3-15(11-16)12-22/h2-11H,13H2,1H3