(2E)-2-[(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(3-chloro-4-ethoxy-5-methoxy-phenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)-2-pivaloyl-acrylonitrile Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=C(C#N)C(=O)C(C)(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C(\C#N)/C(=O)C(C)(C)C)OC

InChI

InChI=1S/C17H20ClNO3/c1-6-22-15-13(18)8-11(9-14(15)21-5)7-12(10-19)16(20)17(2,3)4/h7-9H,6H2,1-5H3/b12-7+