hexyl 2-(3-cyano-4,5-dimethoxy-phenyl)-2-oxidanylidene-ethanoate

Systemtic Name: hexyl 2-(3-cyano-4,5-dimethoxy-phenyl)-2-oxidanylidene-ethanoate Openeye Name: hexyl 2-(3-cyano-4,5-dimethoxy-phenyl)-2-oxo-acetate CAS Name: 2-(3-cyano-4,5-dimethoxyphenyl)-2-oxoacetic acid hexyl ester IUPAC Name: hexyl 2-(3-cyano-4,5-dimethoxyphenyl)-2-oxoacetate Traditional Name: 2-(3-cyano-4,5-dimethoxy-phenyl)-2-keto-acetic acid hexyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=O)C1=CC(=C(C(=C1)C#N)OC)OC

Isomeric SMILES

CCCCCCOC(=O)C(=O)C1=CC(=C(C(=C1)C#N)OC)OC

InChI

InChI=1S/C17H21NO5/c1-4-5-6-7-8-23-17(20)15(19)12-9-13(11-18)16(22-3)14(10-12)21-2/h9-10H,4-8H2,1-3H3