(2,6-dimethylphenyl) 4-(4-cyano-2-methoxy-phenoxy)butanoate

Systemtic Name: (2,6-dimethylphenyl) 4-(4-cyano-2-methoxy-phenoxy)butanoate Openeye Name: (2,6-dimethylphenyl) 4-(4-cyano-2-methoxy-phenoxy)butanoate CAS Name: 4-(4-cyano-2-methoxyphenoxy)butanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-(4-cyano-2-methoxyphenoxy)butanoate Traditional Name: 4-(4-cyano-2-methoxy-phenoxy)butyric acid (2,6-dimethylphenyl) ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CCCOC2=C(C=C(C=C2)C#N)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CCCOC2=C(C=C(C=C2)C#N)OC

InChI

InChI=1S/C20H21NO4/c1-14-6-4-7-15(2)20(14)25-19(22)8-5-11-24-17-10-9-16(13-21)12-18(17)23-3/h4,6-7,9-10,12H,5,8,11H2,1-3H3