ethyl 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluoranyl-phenyl)ethanoate

Systemtic Name: ethyl 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluoranyl-phenyl)ethanoate Openeye Name: ethyl 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluoro-phenyl)acetate CAS Name: 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluorophenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluorophenyl)acetate Traditional Name: 2-(4-tert-butylphenyl)-2-(2-cyano-3-fluoro-phenyl)acetic acid ethyl ester Formula: C21H22FNO2 MolecularWeight: 339.403283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22FNO2/c1-5-25-20(24)19(16-7-6-8-18(22)17(16)13-23)14-9-11-15(12-10-14)21(2,3)4/h6-12,19H,5H2,1-4H3