2-(4-cyano-2-ethoxy-phenoxy)butanoic acid

Systemtic Name: 2-(4-cyano-2-ethoxy-phenoxy)butanoic acid Openeye Name: 2-(4-cyano-2-ethoxy-phenoxy)butanoic acid CAS Name: 2-(4-cyano-2-ethoxyphenoxy)butanoic acid IUPAC Name: 2-(4-cyano-2-ethoxyphenoxy)butanoic acid Traditional Name: 2-(4-cyano-2-ethoxy-phenoxy)butyric acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=C(C=C(C=C1)C#N)OCC

Isomeric SMILES

CCC(C(=O)O)OC1=C(C=C(C=C1)C#N)OCC

InChI

InChI=1S/C13H15NO4/c1-3-10(13(15)16)18-11-6-5-9(8-14)7-12(11)17-4-2/h5-7,10H,3-4H2,1-2H3,(H,15,16)