[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-[2-oxo-5-(trifluoromethyl)-1-pyridyl]acetate CAS Name: 2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-[2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetate Traditional Name: 2-[2-keto-5-(trifluoromethyl)-1-pyridyl]acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H12F3N3O4 MolecularWeight: 343.25799

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CN1C=C(C=CC1=O)C(F)(F)F)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CN1C=C(C=CC1=O)C(F)(F)F)/N

InChI

InChI=1S/C14H12F3N3O4/c1-8(19)10(4-18)11(21)7-24-13(23)6-20-5-9(14(15,16)17)2-3-12(20)22/h2-3,5H,6-7,19H2,1H3/b10-8+