ethyl 3-(cyanomethyl)-2,2-bis(fluoranyl)-4-phenoxy-butanoate

Systemtic Name: ethyl 3-(cyanomethyl)-2,2-bis(fluoranyl)-4-phenoxy-butanoate Openeye Name: ethyl 3-(cyanomethyl)-2,2-difluoro-4-phenoxy-butanoate CAS Name: 3-(cyanomethyl)-2,2-difluoro-4-phenoxybutanoic acid ethyl ester IUPAC Name: ethyl 3-(cyanomethyl)-2,2-difluoro-4-phenoxybutanoate Traditional Name: 3-(cyanomethyl)-2,2-difluoro-4-phenoxy-butyric acid ethyl ester Formula: C14H15F2NO3 MolecularWeight: 283.270606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC#N)COC1=CC=CC=C1)(F)F

Isomeric SMILES

CCOC(=O)C(C(CC#N)COC1=CC=CC=C1)(F)F

InChI

InChI=1S/C14H15F2NO3/c1-2-19-13(18)14(15,16)11(8-9-17)10-20-12-6-4-3-5-7-12/h3-7,11H,2,8,10H2,1H3