(4-cyano-2-methoxy-phenyl) 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid (4-cyano-2-methoxy-phenyl) ester Formula: C22H15NO4 MolecularWeight: 357.3588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C22H15NO4/c1-25-20-10-14(12-23)6-8-18(20)27-21(24)11-16-13-26-19-9-7-15-4-2-3-5-17(15)22(16)19/h2-10,13H,11H2,1H3