ethyl 3-(4-cyanophenyl)-2-ethanoyl-5-oxidanylidene-4-pyrrolidin-1-ylcarbonyl-5-[[3-(trifluoromethyl)phenyl]amino]pentanoate

Systemtic Name: ethyl 3-(4-cyanophenyl)-2-ethanoyl-5-oxidanylidene-4-pyrrolidin-1-ylcarbonyl-5-[[3-(trifluoromethyl)phenyl]amino]pentanoate Openeye Name: ethyl 2-acetyl-3-(4-cyanophenyl)-5-oxo-4-(pyrrolidine-1-carbonyl)-5-[3-(trifluoromethyl)anilino]pentanoate CAS Name: 2-acetyl-3-(4-cyanophenyl)-5-oxo-4-[oxo(1-pyrrolidinyl)methyl]-5-[3-(trifluoromethyl)anilino]pentanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-(4-cyanophenyl)-5-oxo-4-(pyrrolidine-1-carbonyl)-5-[3-(trifluoromethyl)anilino]pentanoate Traditional Name: 2-acetyl-3-(4-cyanophenyl)-5-keto-4-(pyrrolidine-1-carbonyl)-5-[3-(trifluoromethyl)anilino]valeric acid ethyl ester Formula: C28H28F3N3O5 MolecularWeight: 543.53423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)C#N)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCCC3)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)C#N)C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)N3CCCC3)C(=O)C

InChI

InChI=1S/C28H28F3N3O5/c1-3-39-27(38)22(17(2)35)23(19-11-9-18(16-32)10-12-19)24(26(37)34-13-4-5-14-34)25(36)33-21-8-6-7-20(15-21)28(29,30)31/h6-12,15,22-24H,3-5,13-14H2,1-2H3,(H,33,36)