(4-cyanophenyl)methyl 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (4-cyanophenyl)methyl 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid (4-cyanobenzyl) ester Formula: C22H15NO3 MolecularWeight: 341.3594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CO3)CC(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CO3)CC(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H15NO3/c23-12-15-5-7-16(8-6-15)13-26-21(24)11-18-14-25-20-10-9-17-3-1-2-4-19(17)22(18)20/h1-10,14H,11,13H2