2-[4-(4-cyanophenyl)phenoxy]ethyl 2,2-dimethylbutanoate

Systemtic Name: 2-[4-(4-cyanophenyl)phenoxy]ethyl 2,2-dimethylbutanoate Openeye Name: 2-[4-(4-cyanophenyl)phenoxy]ethyl 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid 2-[4-(4-cyanophenyl)phenoxy]ethyl ester IUPAC Name: 2-[4-(4-cyanophenyl)phenoxy]ethyl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid 2-[4-(4-cyanophenyl)phenoxy]ethyl ester Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(C)(C)C(=O)OCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H23NO3/c1-4-21(2,3)20(23)25-14-13-24-19-11-9-18(10-12-19)17-7-5-16(15-22)6-8-17/h5-12H,4,13-14H2,1-3H3