ethyl 3-methylidene-4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]hexanoate

Systemtic Name: ethyl 3-methylidene-4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]hexanoate Openeye Name: ethyl 3-methylene-4-oxo-2-[3-(trifluoromethyl)anilino]hexanoate CAS Name: 3-methylene-4-oxo-2-[3-(trifluoromethyl)anilino]hexanoic acid ethyl ester IUPAC Name: ethyl 3-methylidene-4-oxo-2-[3-(trifluoromethyl)anilino]hexanoate Traditional Name: 3-propionyl-2-[3-(trifluoromethyl)anilino]but-3-enoic acid ethyl ester Formula: C16H18F3NO3 MolecularWeight: 329.31423

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=C)C(C(=O)OCC)NC1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CCC(=O)C(=C)C(C(=O)OCC)NC1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C16H18F3NO3/c1-4-13(21)10(3)14(15(22)23-5-2)20-12-8-6-7-11(9-12)16(17,18)19/h6-9,14,20H,3-5H2,1-2H3