(4-azanyl-3-ethanoyl-2-oxidanylidene-pent-3-enyl) 2-[[3-(trifluoromethyl)phenyl]amino]benzoate

Systemtic Name: (4-azanyl-3-ethanoyl-2-oxidanylidene-pent-3-enyl) 2-[[3-(trifluoromethyl)phenyl]amino]benzoate Openeye Name: (3-acetyl-4-amino-2-oxo-pent-3-enyl) 2-[3-(trifluoromethyl)anilino]benzoate CAS Name: 2-[3-(trifluoromethyl)anilino]benzoic acid (3-acetyl-4-amino-2-oxopent-3-enyl) ester IUPAC Name: (3-acetyl-4-amino-2-oxopent-3-enyl) 2-[3-(trifluoromethyl)anilino]benzoate Traditional Name: 2-[3-(trifluoromethyl)anilino]benzoic acid (3-acetyl-4-amino-2-keto-pent-3-enyl) ester Formula: C21H19F3N2O4 MolecularWeight: 420.38177

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)C(=O)COC(=O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F)N

Isomeric SMILES

CC(=C(C(=O)C)C(=O)COC(=O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F)N

InChI

InChI=1S/C21H19F3N2O4/c1-12(25)19(13(2)27)18(28)11-30-20(29)16-8-3-4-9-17(16)26-15-7-5-6-14(10-15)21(22,23)24/h3-10,26H,11,25H2,1-2H3