methyl 4-methyl-2-[[3-methyl-2-(2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoyl]amino]-2-(trifluoromethyl)pentanoate

Systemtic Name: methyl 4-methyl-2-[[3-methyl-2-(2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoyl]amino]-2-(trifluoromethyl)pentanoate Openeye Name: methyl 4-methyl-2-[[3-methyl-2-(2-oxo-4-phenyl-azetidin-1-yl)butanoyl]amino]-2-(trifluoromethyl)pentanoate CAS Name: 4-methyl-2-[[3-methyl-1-oxo-2-(2-oxo-4-phenyl-1-azetidinyl)butyl]amino]-2-(trifluoromethyl)pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[3-methyl-2-(2-oxo-4-phenylazetidin-1-yl)butanoyl]amino]-2-(trifluoromethyl)pentanoate Traditional Name: 2-[[2-(2-keto-4-phenyl-azetidin-1-yl)-3-methyl-butanoyl]amino]-4-methyl-2-(trifluoromethyl)valeric acid methyl ester Formula: C22H29F3N2O4 MolecularWeight: 442.47187

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)(C(F)(F)F)NC(=O)C(C(C)C)N1C(CC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)OC)(C(F)(F)F)NC(=O)C(C(C)C)N1C(CC1=O)C2=CC=CC=C2

InChI

InChI=1S/C22H29F3N2O4/c1-13(2)12-21(20(30)31-5,22(23,24)25)26-19(29)18(14(3)4)27-16(11-17(27)28)15-9-7-6-8-10-15/h6-10,13-14,16,18H,11-12H2,1-5H3,(H,26,29)