methyl (E)-3-chloranyl-2-cyano-4,4,4-tris(fluoranyl)but-2-enoate

Systemtic Name: methyl (E)-3-chloranyl-2-cyano-4,4,4-tris(fluoranyl)but-2-enoate Openeye Name: methyl (E)-3-chloro-2-cyano-4,4,4-trifluoro-but-2-enoate CAS Name: (E)-3-chloro-2-cyano-4,4,4-trifluoro-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-chloro-2-cyano-4,4,4-trifluorobut-2-enoate Traditional Name: (E)-3-chloro-2-cyano-4,4,4-trifluoro-but-2-enoic acid methyl ester Formula: C6H3ClF3NO2 MolecularWeight: 213.54173

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(C(F)(F)F)Cl)C#N

Isomeric SMILES

COC(=O)/C(=C(\C(F)(F)F)/Cl)/C#N

InChI

InChI=1S/C6H3ClF3NO2/c1-13-5(12)3(2-11)4(7)6(8,9)10/h1H3/b4-3+