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

Systemtic Name: [4-(4-cyanophenyl)phenoxy]methyl 2,2-dimethylbutanoate Openeye Name: [4-(4-cyanophenyl)phenoxy]methyl 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid [4-(4-cyanophenyl)phenoxy]methyl ester IUPAC Name: [4-(4-cyanophenyl)phenoxy]methyl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid [4-(4-cyanophenyl)phenoxy]methyl ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(C)(C)C(=O)OCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H21NO3/c1-4-20(2,3)19(22)24-14-23-18-11-9-17(10-12-18)16-7-5-15(13-21)6-8-16/h5-12H,4,14H2,1-3H3