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

Systemtic Name: ethyl 4-cyano-4-(3,4-dimethoxyphenyl)-3-phenyl-butanoate Openeye Name: ethyl 4-cyano-4-(3,4-dimethoxyphenyl)-3-phenyl-butanoate CAS Name: 4-cyano-4-(3,4-dimethoxyphenyl)-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-4-(3,4-dimethoxyphenyl)-3-phenylbutanoate Traditional Name: 4-cyano-4-(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)CC(C1=CC=CC=C1)C(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

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

InChI

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