[1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]propan-2-yl] 3-methyl-2-phenyl-pentanoate

Systemtic Name: [1-oxidanylidene-1-[[2-(trifluoromethyl)phenyl]amino]propan-2-yl] 3-methyl-2-phenyl-pentanoate Openeye Name: [1-methyl-2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 3-methyl-2-phenyl-pentanoate CAS Name: 3-methyl-2-phenylpentanoic acid [1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl] 3-methyl-2-phenylpentanoate Traditional Name: 3-methyl-2-phenyl-valeric acid [2-keto-1-methyl-2-[2-(trifluoromethyl)anilino]ethyl] ester Formula: C22H24F3NO3 MolecularWeight: 407.42607

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCC(C)C(C1=CC=CC=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C22H24F3NO3/c1-4-14(2)19(16-10-6-5-7-11-16)21(28)29-15(3)20(27)26-18-13-9-8-12-17(18)22(23,24)25/h5-15,19H,4H2,1-3H3,(H,26,27)