methyl 2-[3-chloranyl-2,6-bis(fluoranyl)phenyl]-3-cyano-propanoate

Systemtic Name: methyl 2-[3-chloranyl-2,6-bis(fluoranyl)phenyl]-3-cyano-propanoate Openeye Name: methyl 2-(3-chloro-2,6-difluoro-phenyl)-3-cyano-propanoate CAS Name: 2-(3-chloro-2,6-difluorophenyl)-3-cyanopropanoic acid methyl ester IUPAC Name: methyl 2-(3-chloro-2,6-difluorophenyl)-3-cyanopropanoate Traditional Name: 2-(3-chloro-2,6-difluoro-phenyl)-3-cyano-propionic acid methyl ester Formula: C11H8ClF2NO2 MolecularWeight: 259.636526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC#N)C1=C(C=CC(=C1F)Cl)F

Isomeric SMILES

COC(=O)C(CC#N)C1=C(C=CC(=C1F)Cl)F

InChI

InChI=1S/C11H8ClF2NO2/c1-17-11(16)6(4-5-15)9-8(13)3-2-7(12)10(9)14/h2-3,6H,4H2,1H3