ethyl 2-[3-(2-chloranylphenoxy)-2-methoxy-phenyl]-2-cyano-butanoate

Systemtic Name: ethyl 2-[3-(2-chloranylphenoxy)-2-methoxy-phenyl]-2-cyano-butanoate Openeye Name: ethyl 2-[3-(2-chlorophenoxy)-2-methoxy-phenyl]-2-cyano-butanoate CAS Name: 2-[3-(2-chlorophenoxy)-2-methoxyphenyl]-2-cyanobutanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-chlorophenoxy)-2-methoxyphenyl]-2-cyanobutanoate Traditional Name: 2-[3-(2-chlorophenoxy)-2-methoxy-phenyl]-2-cyano-butyric acid ethyl ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)(C1=C(C(=CC=C1)OC2=CC=CC=C2Cl)OC)C(=O)OCC

Isomeric SMILES

CCC(C#N)(C1=C(C(=CC=C1)OC2=CC=CC=C2Cl)OC)C(=O)OCC

InChI

InChI=1S/C20H20ClNO4/c1-4-20(13-22,19(23)25-5-2)14-9-8-12-17(18(14)24-3)26-16-11-7-6-10-15(16)21/h6-12H,4-5H2,1-3H3