3-(4-cyano-2-ethoxy-phenoxy)propanoate

Systemtic Name: 3-(4-cyano-2-ethoxy-phenoxy)propanoate Openeye Name: 3-(4-cyano-2-ethoxy-phenoxy)propanoate CAS Name: 3-(4-cyano-2-ethoxyphenoxy)propanoate IUPAC Name: 3-(4-cyano-2-ethoxyphenoxy)propanoate Traditional Name: 3-(4-cyano-2-ethoxy-phenoxy)propionate Formula: C12H12NO4- MolecularWeight: 234.22798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCCC(=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-2-16-11-7-9(8-13)3-4-10(11)17-6-5-12(14)15/h3-4,7H,2,5-6H2,1H3,(H,14,15)/p-1