ethyl 2-cyano-3-oxidanylidene-3-[2-[[3-(trifluoromethyl)phenyl]amino]pyridin-3-yl]propanoate

Systemtic Name: ethyl 2-cyano-3-oxidanylidene-3-[2-[[3-(trifluoromethyl)phenyl]amino]pyridin-3-yl]propanoate Openeye Name: ethyl 2-cyano-3-oxo-3-[2-[3-(trifluoromethyl)anilino]-3-pyridyl]propanoate CAS Name: 2-cyano-3-oxo-3-[2-[3-(trifluoromethyl)anilino]-3-pyridinyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-3-oxo-3-[2-[3-(trifluoromethyl)anilino]pyridin-3-yl]propanoate Traditional Name: 2-cyano-3-keto-3-[2-[3-(trifluoromethyl)anilino]-3-pyridyl]propionic acid ethyl ester Formula: C18H14F3N3O3 MolecularWeight: 377.31727

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(=O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(C#N)C(=O)C1=C(N=CC=C1)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O3/c1-2-27-17(26)14(10-22)15(25)13-7-4-8-23-16(13)24-12-6-3-5-11(9-12)18(19,20)21/h3-9,14H,2H2,1H3,(H,23,24)