2-(4-cyanophenoxy)ethyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 4-(3,4-dimethoxyphenyl)-4-oxidanylidene-butanoate Openeye Name: 2-(4-cyanophenoxy)ethyl 4-(3,4-dimethoxyphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethoxyphenyl)-4-oxobutanoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 4-(3,4-dimethoxyphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethoxyphenyl)-4-keto-butyric acid 2-(4-cyanophenoxy)ethyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)OCCOC2=CC=C(C=C2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)OCCOC2=CC=C(C=C2)C#N)OC

InChI

InChI=1S/C21H21NO6/c1-25-19-9-5-16(13-20(19)26-2)18(23)8-10-21(24)28-12-11-27-17-6-3-15(14-22)4-7-17/h3-7,9,13H,8,10-12H2,1-2H3