[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid [(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl ester IUPAC Name: [(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid [(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)COC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21NO5/c1-3-24-19-9-16-8-14(2)27-20(16)10-17(19)12-26-21(23)13-25-18-6-4-15(11-22)5-7-18/h4-7,9-10,14H,3,8,12-13H2,1-2H3/t14-/m0/s1