(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[2-oxo-5-(trifluoromethyl)-1-pyridyl]acetate CAS Name: 2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-[2-oxo-5-(trifluoromethyl)pyridin-1-yl]acetate Traditional Name: 2-[2-keto-5-(trifluoromethyl)-1-pyridyl]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H12F3N3O4 MolecularWeight: 343.25799

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

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/h2-3,5,10,19H,6-7H2,1H3