(2E)-2-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(3-ethoxy-4-phenylmethoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(4-benzyloxy-3-ethoxy-phenyl)methylene]-4-methyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-4-methyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(3-ethoxy-4-phenylmethoxyphenyl)methylidene]-4-methyl-3-oxopentanenitrile Traditional Name: (E)-3-(4-benzoxy-3-ethoxy-phenyl)-2-isobutyryl-acrylonitrile Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C(C)C)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C(C)C)OCC2=CC=CC=C2

InChI

InChI=1S/C22H23NO3/c1-4-25-21-13-18(12-19(14-23)22(24)16(2)3)10-11-20(21)26-15-17-8-6-5-7-9-17/h5-13,16H,4,15H2,1-3H3/b19-12+