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

Systemtic Name: (2E)-2-[(3-methoxy-4-pentoxy-phenyl)methylidene]-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-[(3-methoxy-4-pentoxy-phenyl)methylene]-3-oxo-butanenitrile CAS Name: (2E)-2-[(3-methoxy-4-pentoxyphenyl)methylidene]-3-oxobutanenitrile IUPAC Name: (2E)-2-[(3-methoxy-4-pentoxyphenyl)methylidene]-3-oxobutanenitrile Traditional Name: (E)-2-acetyl-3-(4-amoxy-3-methoxy-phenyl)acrylonitrile Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)C)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C)OC

InChI

InChI=1S/C17H21NO3/c1-4-5-6-9-21-16-8-7-14(11-17(16)20-3)10-15(12-18)13(2)19/h7-8,10-11H,4-6,9H2,1-3H3/b15-10+