(2E)-2-[(3-methoxy-4-octoxy-phenyl)methylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-[(3-methoxy-4-octoxy-phenyl)methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-[(3-methoxy-4-octoxy-phenyl)methylene]-3-oxo-butanenitrile CAS Name: (2E)-2-[(3-methoxy-4-octoxyphenyl)methylidene]-3-oxobutanenitrile IUPAC Name: (2E)-2-[(3-methoxy-4-octoxyphenyl)methylidene]-3-oxobutanenitrile Traditional Name: (E)-2-acetyl-3-(3-methoxy-4-octoxy-phenyl)acrylonitrile Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)C)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C)OC

InChI

InChI=1S/C20H27NO3/c1-4-5-6-7-8-9-12-24-19-11-10-17(14-20(19)23-3)13-18(15-21)16(2)22/h10-11,13-14H,4-9,12H2,1-3H3/b18-13+