ethyl 2-cyano-2-(3,4-dimethoxyphenyl)-3-methyl-butanoate

Systemtic Name: ethyl 2-cyano-2-(3,4-dimethoxyphenyl)-3-methyl-butanoate Openeye Name: ethyl 2-cyano-2-(3,4-dimethoxyphenyl)-3-methyl-butanoate CAS Name: 2-cyano-2-(3,4-dimethoxyphenyl)-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3,4-dimethoxyphenyl)-3-methylbutanoate Traditional Name: 2-cyano-2-(3,4-dimethoxyphenyl)-3-methyl-butyric acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-6-21-15(18)16(10-17,11(2)3)12-7-8-13(19-4)14(9-12)20-5/h7-9,11H,6H2,1-5H3