4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[2-(trifluoromethyl)phenyl]propan-2-yl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[1-oxidanyl-1-oxidanylidene-3-[2-(trifluoromethyl)phenyl]propan-2-yl]amino]pentanoic acid Openeye Name: 2-[[2-hydroxy-2-oxo-1-[[2-(trifluoromethyl)phenyl]methyl]ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[1-hydroxy-1-oxo-3-[2-(trifluoromethyl)phenyl]propan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[1-hydroxy-1-oxo-3-[2-(trifluoromethyl)phenyl]propan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-hydroxy-2-keto-1-[2-(trifluoromethyl)benzyl]ethyl]amino]-4-methyl-valeric acid Formula: C16H20F3NO4 MolecularWeight: 347.32951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=CC=CC=C1C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CC1=CC=CC=C1C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H20F3NO4/c1-9(2)7-12(14(21)22)20-13(15(23)24)8-10-5-3-4-6-11(10)16(17,18)19/h3-6,9,12-13,20H,7-8H2,1-2H3,(H,21,22)(H,23,24)