[2-methyl-3-oxidanylidene-4-[3-(trifluoromethyl)phenoxy]butan-2-yl]phosphonic acid

Systemtic Name: [2-methyl-3-oxidanylidene-4-[3-(trifluoromethyl)phenoxy]butan-2-yl]phosphonic acid Openeye Name: [1,1-dimethyl-2-oxo-3-[3-(trifluoromethyl)phenoxy]propyl]phosphonic acid CAS Name: [2-methyl-3-oxo-4-[3-(trifluoromethyl)phenoxy]butan-2-yl]phosphonic acid IUPAC Name: [2-methyl-3-oxo-4-[3-(trifluoromethyl)phenoxy]butan-2-yl]phosphonic acid Traditional Name: [2-keto-1,1-dimethyl-3-[3-(trifluoromethyl)phenoxy]propyl]phosphonic acid Formula: C12H14F3O5P MolecularWeight: 326.205531

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)COC1=CC=CC(=C1)C(F)(F)F)P(=O)(O)O

Isomeric SMILES

CC(C)(C(=O)COC1=CC=CC(=C1)C(F)(F)F)P(=O)(O)O

InChI

InChI=1S/C12H14F3O5P/c1-11(2,21(17,18)19)10(16)7-20-9-5-3-4-8(6-9)12(13,14)15/h3-6H,7H2,1-2H3,(H2,17,18,19)