(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(3-methoxyphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-(3-methoxybenzoyl)prop-2-enenitrile CAS Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-[(3-methoxyphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(3-methoxybenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-2-m-anisoyl-acrylonitrile Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=C(C#N)C(=O)C3=CC(=CC=C3)OC)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C(\C#N)/C(=O)C3=CC(=CC=C3)OC)O[C@H](C2)C

InChI

InChI=1S/C22H21NO4/c1-4-26-20-11-16-8-14(2)27-21(16)12-17(20)9-18(13-23)22(24)15-6-5-7-19(10-15)25-3/h5-7,9-12,14H,4,8H2,1-3H3/b18-9+/t14-/m0/s1