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

Systemtic Name: ethyl 4-cyano-2-(3,4-dimethoxyphenyl)-3-phenyl-butanoate Openeye Name: ethyl 4-cyano-2-(3,4-dimethoxyphenyl)-3-phenyl-butanoate CAS Name: 4-cyano-2-(3,4-dimethoxyphenyl)-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-2-(3,4-dimethoxyphenyl)-3-phenylbutanoate Traditional Name: 4-cyano-2-(3,4-dimethoxyphenyl)-3-phenyl-butyric acid ethyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(C=C1)OC)OC)C(CC#N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C1=CC(=C(C=C1)OC)OC)C(CC#N)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO4/c1-4-26-21(23)20(16-10-11-18(24-2)19(14-16)25-3)17(12-13-22)15-8-6-5-7-9-15/h5-11,14,17,20H,4,12H2,1-3H3