(2R,3S)-2-acetyloxy-3-(2-fluoranylpropan-2-yl)butanedioic acid

Systemtic Name: (2R,3S)-2-acetyloxy-3-(2-fluoranylpropan-2-yl)butanedioic acid Openeye Name: (2R,3S)-2-acetoxy-3-(1-fluoro-1-methyl-ethyl)butanedioic acid CAS Name: (2R,3S)-2-acetyloxy-3-(2-fluoropropan-2-yl)butanedioic acid IUPAC Name: (2R,3S)-2-acetyloxy-3-(2-fluoropropan-2-yl)butanedioic acid Traditional Name: (2R,3S)-2-acetoxy-3-(1-fluoro-1-methyl-ethyl)succinic acid Formula: C9H13FO6 MolecularWeight: 236.194323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(C(=O)O)C(C)(C)F)C(=O)O

Isomeric SMILES

CC(=O)O[C@H]([C@@H](C(=O)O)C(C)(C)F)C(=O)O

InChI

InChI=1S/C9H13FO6/c1-4(11)16-6(8(14)15)5(7(12)13)9(2,3)10/h5-6H,1-3H3,(H,12,13)(H,14,15)/t5-,6+/m0/s1