2-[[2,2-bis(fluoranyl)-5-methyl-3-oxidanylidene-hexanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2,2-bis(fluoranyl)-5-methyl-3-oxidanylidene-hexanoyl]amino]ethanoic acid Openeye Name: 2-[(2,2-difluoro-5-methyl-3-oxo-hexanoyl)amino]acetic acid CAS Name: 2-[(2,2-difluoro-5-methyl-1,3-dioxohexyl)amino]acetic acid IUPAC Name: 2-[(2,2-difluoro-5-methyl-3-oxohexanoyl)amino]acetic acid Traditional Name: 2-[(2,2-difluoro-3-keto-5-methyl-hexanoyl)amino]acetic acid Formula: C9H13F2NO4 MolecularWeight: 237.200626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(=O)NCC(=O)O)(F)F

Isomeric SMILES

CC(C)CC(=O)C(C(=O)NCC(=O)O)(F)F

InChI

InChI=1S/C9H13F2NO4/c1-5(2)3-6(13)9(10,11)8(16)12-4-7(14)15/h5H,3-4H2,1-2H3,(H,12,16)(H,14,15)