2-cyanoethyl (E)-3-oxidanylidene-5-[2-(trifluoromethyl)phenyl]pent-4-enoate

Systemtic Name: 2-cyanoethyl (E)-3-oxidanylidene-5-[2-(trifluoromethyl)phenyl]pent-4-enoate Openeye Name: 2-cyanoethyl (E)-3-oxo-5-[2-(trifluoromethyl)phenyl]pent-4-enoate CAS Name: (E)-3-oxo-5-[2-(trifluoromethyl)phenyl]-4-pentenoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (E)-3-oxo-5-[2-(trifluoromethyl)phenyl]pent-4-enoate Traditional Name: (E)-3-keto-5-[2-(trifluoromethyl)phenyl]pent-4-enoic acid 2-cyanoethyl ester Formula: C15H12F3NO3 MolecularWeight: 311.25589

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)CC(=O)OCCC#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)CC(=O)OCCC#N)C(F)(F)F

InChI

InChI=1S/C15H12F3NO3/c16-15(17,18)13-5-2-1-4-11(13)6-7-12(20)10-14(21)22-9-3-8-19/h1-2,4-7H,3,9-10H2/b7-6+