(5-cyano-3,3-dimethyl-2H-1-benzofuran-2-yl) ethanoate

Systemtic Name: (5-cyano-3,3-dimethyl-2H-1-benzofuran-2-yl) ethanoate Openeye Name: (5-cyano-3,3-dimethyl-2H-benzofuran-2-yl) acetate CAS Name: acetic acid (5-cyano-3,3-dimethyl-2H-benzofuran-2-yl) ester IUPAC Name: (5-cyano-3,3-dimethyl-2H-1-benzofuran-2-yl) acetate Traditional Name: acetic acid (5-cyano-3,3-dimethyl-coumaran-2-yl) ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(O1)C=CC(=C2)C#N)(C)C

Isomeric SMILES

CC(=O)OC1C(C2=C(O1)C=CC(=C2)C#N)(C)C

InChI

InChI=1S/C13H13NO3/c1-8(15)16-12-13(2,3)10-6-9(7-14)4-5-11(10)17-12/h4-6,12H,1-3H3