(phenylmethyl) 2-[2-[2-(5-cyano-1-benzofuran-2-yl)ethyl]-5-methoxy-phenyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[2-[2-(5-cyano-1-benzofuran-2-yl)ethyl]-5-methoxy-phenyl]ethanoate Openeye Name: benzyl 2-[2-[2-(5-cyanobenzofuran-2-yl)ethyl]-5-methoxy-phenyl]acetate CAS Name: 2-[2-[2-(5-cyano-2-benzofuranyl)ethyl]-5-methoxyphenyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[2-(5-cyano-1-benzofuran-2-yl)ethyl]-5-methoxyphenyl]acetate Traditional Name: 2-[2-[2-(5-cyanobenzofuran-2-yl)ethyl]-5-methoxy-phenyl]acetic acid benzyl ester Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CCC2=CC3=C(O2)C=CC(=C3)C#N)CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)CCC2=CC3=C(O2)C=CC(=C3)C#N)CC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23NO4/c1-30-24-10-8-21(9-11-25-15-23-13-20(17-28)7-12-26(23)32-25)22(14-24)16-27(29)31-18-19-5-3-2-4-6-19/h2-8,10,12-15H,9,11,16,18H2,1H3