(4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)COC2=CC=C(C=C2)C#N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)COC2=CC=C(C=C2)C#N)C)C(C)(C)C

InChI

InChI=1S/C22H25NO3/c1-15-10-18(22(3,4)5)11-16(2)20(15)13-26-21(24)14-25-19-8-6-17(12-23)7-9-19/h6-11H,13-14H2,1-5H3