[(1R)-1-cyanoethyl] 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: [(1R)-1-cyanoethyl] 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid [(1R)-1-cyanoethyl] ester Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C#N)OC(=O)CC1=COC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C17H13NO3/c1-11(9-18)21-16(19)8-13-10-20-15-7-6-12-4-2-3-5-14(12)17(13)15/h2-7,10-11H,8H2,1H3/t11-/m1/s1