ethyl (E)-2-cyano-4,4,4-tris(fluoranyl)but-2-enoate

Systemtic Name: ethyl (E)-2-cyano-4,4,4-tris(fluoranyl)but-2-enoate Openeye Name: ethyl (E)-2-cyano-4,4,4-trifluoro-but-2-enoate CAS Name: (E)-2-cyano-4,4,4-trifluoro-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-4,4,4-trifluorobut-2-enoate Traditional Name: (E)-2-cyano-4,4,4-trifluoro-but-2-enoic acid ethyl ester Formula: C7H6F3NO2 MolecularWeight: 193.12325

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C(=C/C(F)(F)F)/C#N

InChI

InChI=1S/C7H6F3NO2/c1-2-13-6(12)5(4-11)3-7(8,9)10/h3H,2H2,1H3/b5-3+